4-Isopropyl-3-methylphenol supplier

Name
4-ISOPROPYL-3-METHYLPHENOL
EINECS 217-105-4
CAS No. 3228-02-2
Article Data47
CAS DataBase
Density 0.974 g/cm³
Solubility insoluble in water
Melting Point 111-114 °C(lit.)
Formula C₁₀H₁₄O
Boiling Point 233.8 °C at 760 mmHg
Molecular Weight 150.221
Flash Point 104.1 °C
Transport Information UN 1759
Appearance White needle crystal
Safety 26-37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms m-Cresol,4-isopropyl- (4CI);o-Cymen-5-ol (7CI,8CI);1-Hydroxy-3-methyl-4-isopropylbenzene;3-Methyl-4-(1-methylethyl)phenol;3-Methyl-4-isopropylphenol;4-Isopropyl-5-methylphenol;4-Isopropyl-m-cresol;5-Methyl-4-isopropylphenol;Biosol;Biosol (antibacterial);Frecide;NSC 62111;p-Thymol;
PSA 20.23000
LogP 2.82400

Synthetic route

: 3228-01-1
3-methyl-2-isopropyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With carbon disulfide; aluminium trichloride at 50 - 60℃;
With phosphorus pentoxide at 210 - 215℃; Erhitzen des Reaktionsprodukts mit konz. wss. Alkalilauge auf 220grad;

: 19177-04-9
1-isopropoxy-3-methylbenzene

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
Einleiten von BF3;
With aluminium trichloride
With phosphorus pentoxide at 130℃; Erhitzen mit konz. wss. Alkalilauge auf 220grad;

: 30061-94-0
6-tert-butyl-4-isopropyl-3-methylphenol

: 3228-02-2
3-Methyl-4-isopropylphenol

Conditions

Conditions	Yield
With Fuller-earth; benzene at 265℃;

: 187737-37-7
propene

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With solid phosphoric acid/silica support titania at 250℃; under 12001.2 Torr; for 1h; Autoclave;
With Fuller's Earth at 230℃;
With phosphoric acid at 230℃;
With phosphorus pentoxide at 230℃;
With zinc(II) chloride at 230℃;

...Expand

: 540-54-5
1-Chloropropane

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With zinc(II) oxide at 230℃;
With zinc(II) oxide at 230℃;

...Expand

: 75-29-6
isopropyl chloride

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With aluminium trichloride; 1,2-dichloro-ethane at -10 - 0℃;

...Expand

: 108-20-3
di-isopropyl ether

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With Fuller's Earth at 140 - 150℃;
With Fuller's Earth at 230 - 250℃;
at 350℃;

...Expand

: 111-43-3
Dipropyl ether

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With Fuller's Earth at 140 - 150℃;
With Fuller's Earth at 230 - 250℃;

...Expand

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

: 3228-02-2
3-Methyl-4-isopropylphenol

Conditions

Conditions	Yield
With sulfuric acid at 80℃;
With amberlyst-15; carbon dioxide; hydrogen; platinum at 200℃; under 75006 Torr; for 8h; Friedel-Craft alkylation;	30 % Chromat.

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
With tungstophosphoric acid at 160℃;
With phosphoric acid at 150℃;
With aluminium trichloride at 125℃;

...Expand

: 108-39-4
3-methyl-phenol

: 3228-02-2
3-Methyl-4-isopropylphenol

Conditions

Conditions	Yield
With sulfuric acid Erwaermen mit Propanol-(2) unter Zusatz von konz. Schwefelsaeure auf 65-70grad und anschliessendes Erhitzen mit Wasser unter Durchleiten von Wasserdampf;

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
at 120 - 125℃; Sulfurieren, Beh. der Sulfonsaeure mit Isopropylalkohol od. Propylalkohol in Gegenw. v. Schwefelsaeure u. nachf. Destillieren mit Wasserdampf;
durch Sulfurieren; Behandeln der Sulfonsaeure mit Propylalkohol oder Isopropylalkohol in Gegenwart von Schwefelsaeure und folgende Destillation mit Wasserdampf bei 120-125grad;
durch Sulfonieren, Behandeln der Sulfonsaeure mit Propylalkohol oder Isopropylalkohol in Gegenwart von Schwefelsaeure und nachfolgende Destillation mit Wasserdampf bei 120-125grad;

: 4534-10-5
4-Isopropyl-3-methylaniline

: 3228-02-2
3-Methyl-4-isopropylphenol

Conditions

Conditions	Yield
With sulfuric acid; sodium nitrite

: 121194-62-5
1-(2-Hydroxy-5-isopropyl-4-methyl-phenyl)-propan-1-one

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 2886-52-4
1-(2-hydroxy-4-methyl-phenyl)-propan-1-one

Conditions

Conditions	Yield
With aluminium trichloride In chlorobenzene 1.) 20 deg C, 20 h, 2.) 50 deg C, 4 h, 3) 100 deg C, 2 h;	A 6 % Chromat. B 85 % Chromat.

: 86119-84-8, 7664-38-2
phosphoric acid

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

: 3228-02-2
3-Methyl-4-isopropylphenol

Conditions

Conditions	Yield
at 150℃;

...Expand

: 540-54-5
1-Chloropropane

: 108-39-4
3-methyl-phenol

ZnO: ZnO

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

Conditions

Conditions	Yield
at 230℃;

...Expand

: 7446-70-0
aluminium trichloride

: 75-29-6
isopropyl chloride

: 108-39-4
3-methyl-phenol

: 107-06-2
1,2-dichloro-ethane

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-03-3
3-isopropyl-5-methylphenol

Conditions

Conditions	Yield
at -13 - -11℃;

...Expand

: 108-20-3
di-isopropyl ether

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 350℃;

...Expand

: 7446-70-0
aluminium trichloride

: 108-20-3
di-isopropyl ether

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 150 - 350℃; auch in Gegenwart anderer Katalysatoren;

...Expand

: 108-20-3
di-isopropyl ether

: 7664-93-9
sulfuric acid

: 108-39-4
3-methyl-phenol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 160 - 190℃;

...Expand

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 350℃;

...Expand

: 7446-70-0
aluminium trichloride

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 150 - 350℃; auch in Gegenwart anderer Katalysatoren;

...Expand

: 86119-84-8, 7664-38-2
phosphoric acid

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 50 - 60℃;

...Expand

: 7601-90-3
perchloric acid

: 7732-18-5
water

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 100℃;

...Expand

: 71-23-8
propan-1-ol

: 108-39-4
3-methyl-phenol

active Fuller's earth: active Fuller's earth

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 140 - 150℃;

...Expand

: 111-43-3
Dipropyl ether

: 108-39-4
3-methyl-phenol

active Fuller's earth: active Fuller's earth

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 140 - 150℃;

...Expand

: 108-39-4
3-methyl-phenol

: 67-63-0
isopropyl alcohol

tungstophosphoric acid: tungstophosphoric acid

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 160℃;
at 160℃;

...Expand

: 71-23-8
propan-1-ol

: 108-39-4
3-methyl-phenol

ZnCl2: ZnCl2

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 200 - 250℃;

...Expand

: 111-43-3
Dipropyl ether

: 108-39-4
3-methyl-phenol

ZnCl2: ZnCl2

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols: 3-methyl-5-isopropyl-phenol and diisopropyl-m-cresols

Conditions

Conditions	Yield
at 200 - 250℃;

...Expand

: 187737-37-7
propene

: 108-39-4
3-methyl-phenol

Fuller's earth: Fuller's earth

A: 3228-02-2
3-Methyl-4-isopropylphenol

B: 89-83-8
thymol

C: 3228-01-1
3-methyl-2-isopropyl-phenol

D diisopropyl-m-cresols: diisopropyl-m-cresols

Conditions

Conditions	Yield
at 170 - 230℃; (oder andere Katalysatoren);

...Expand

: 3228-02-2
3-Methyl-4-isopropylphenol

: 96-32-2
bromoacetic acid methyl ester

: 649774-36-7
methyl 2-(4-isopropyl-3-methylphenoxy)-acetate

Conditions

Conditions	Yield
With potassium carbonate In butanone for 20h; Heating / reflux;	100%
With potassium carbonate In butanone for 20h; Heating / reflux;	100%
With potassium hydroxide In tetrahydrofuran; dimethyl sulfoxide at 20℃; for 2h;	84.4%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 13154-24-0
triisopropylsilyl chloride

: tri(1-methylethyl)-(4-(1-methylethyl)-3-methylphenoxy)silane

Conditions

Conditions	Yield
With 1H-imidazole In dichloromethane at 20℃; Sealed tube;	99%

: 3228-02-2
3-Methyl-4-isopropylphenol

: C15H10Cl2N2O2

: N-(4-(5-chlorobenzo[d]oxazol-2-yl)phenyl)-2-(4-isopropyl-3-methylphenoxy)acetamide

Conditions

Conditions	Yield
With caesium carbonate In acetonitrile at 20℃; Inert atmosphere;	96%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 35787-71-4
thianthrene cation radical perchlorate

: 5-(2-Hydroxy-5-isopropyl-4-methyl-phenyl)-thianthren-5-ium; perchlorate

Conditions

Conditions	Yield
In acetonitrile for 7h;	95%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 100-39-0
benzyl bromide

: 101747-14-2
4-(isopropyl)-3-methylphenyl benzyl ether

Conditions

Conditions	Yield
With potassium hydroxide In tetrahydrofuran; dimethyl sulfoxide at 20℃; for 2h;	94.7%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 123-62-6
propionic acid anhydride

: 101267-52-1
4-(isopropyl)-3-methylphenyl propionate

Conditions

Conditions	Yield
With pyridine for 24h; Heating;	94%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 358-23-6
trifluoromethylsulfonic anhydride

: C11H13F3O3S

Conditions

Conditions	Yield
With triethylamine In dichloromethane for 1.5h;	94%
With triethylamine In toluene at 20℃; Flow reactor;

: 3228-02-2
3-Methyl-4-isopropylphenol

: 108-24-7
acetic anhydride

: 38770-70-6
3-methyl-4-(1-methylethyl)phenyl ethanoate

Conditions

Conditions	Yield
	93%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 103-80-0
phenylacetyl chloride

: 4-isopropyl-3-methylphenyl phenylacetate

Conditions

Conditions	Yield
With triethylamine In acetonitrile at 20℃; for 5h;	92.3%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 59703-00-3
4-ethyl-2,3-dioxopiperazine-1-carbonyl chloride

: 4-isopropyl-3-methylphenyl N-(4-ethyl-2,3-dioxo-1-piperazine)carbamate

Conditions

Conditions	Yield
With triethylamine In acetonitrile at 20℃; for 4h;	92%

: 75-91-2
tert.-butylhydroperoxide

: 3228-02-2
3-Methyl-4-isopropylphenol

: 4-(tert-butylperoxy)-4-isopropyl-3-methyl-2,5-cyclohexadien-1-one

Conditions

Conditions	Yield
With tris(triphenylphosphine)ruthenium(II) chloride In benzene at 20℃; Inert atmosphere;	92%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 2528-61-2
Heptanoic acid chloride

: 129375-06-0
3-methyl-4-(1-methylethyl)phenyl heptanoate

Conditions

Conditions	Yield
With pyridine	91%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 88419-56-1
2,4,5-trifluorobenzoyl chloride

: 4-isopropyl-3-methylphenyl 2,4,5-trifluorobenzoate

Conditions

Conditions	Yield
Stage #1: 3-Methyl-4-isopropylphenol With triethylamine In acetonitrile for 0.5h; Stage #2: 2,4,5-trifluorobenzoyl chloride In acetonitrile at 0 - 20℃; for 3h;	90.2%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 507-20-0
tertiary butyl chloride

: 30061-94-0
6-tert-butyl-4-isopropyl-3-methylphenol

Conditions

Conditions	Yield
at 80 - 85℃; for 24h;	90%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 1074-12-0
phenylglyoxal hydrate

: 1-(2-hydroxy-5-isopropyl-4-methylphenyl)-2-phenylethane-1,2-dione

Conditions

Conditions	Yield
With copper(II) acetate monohydrate In toluene at 60℃; for 5h;	90%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 446-52-6
2-Fluorobenzaldehyde

: C17H18O2

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 150℃; for 1h;	90%
With potassium carbonate In N,N-dimethyl-formamide at 150℃; for 2h;	80%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 1,2,3,4,6-penta-O-acetyl-D-glucose

: C24H32O10

Conditions

Conditions	Yield
With boron trifluoride diethyl etherate In dichloromethane at 20℃; for 3h;	88.8%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 2,3,6-trifluorobenzoyl chloride

: 4-isopropyl-3-methylphenyl 2,3,6-trifluorobenzoate

Conditions

Conditions	Yield
Stage #1: 3-Methyl-4-isopropylphenol With triethylamine In acetonitrile for 0.5h; Stage #2: 2,3,6-trifluorobenzoyl chloride In acetonitrile at 0 - 20℃; for 3h;	85.3%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 98-88-4
benzoyl chloride

: 143815-16-1
3-methyl-4-(1-methylethyl)phenyl benzoate

Conditions

Conditions	Yield
With sodium hydroxide for 2h; Ambient temperature;	85%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 67462-91-3, 12154-65-3
β-ferrocenylacrylic acid

: 6-isopropyl-7-methyl-4-ferrocenylchroman-2-one

Conditions

Conditions	Yield
With trifluoroacetic acid In dichloromethane at 20℃;	83%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 2905-62-6
3,5-dichlorobenzoyl chloride

: 4-isopropyl-3-methylphenyl 3,5-dichlorobenzoate

Conditions

Conditions	Yield
Stage #1: 3-Methyl-4-isopropylphenol With triethylamine In acetonitrile for 0.5h; Stage #2: 3,5-dichlorobenzoyl chloride In acetonitrile at 0 - 20℃; for 3h;	81.3%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 94088-75-2
2-(2-amino-1,3-thiazol-4-yl)-1-(1,3-benzothiazol-2-ylsulfanyl)-2-(methoxyimino)ethan-1-one

: 4-isopropyl-3-methylphenyl (2-aminothiazol-4-yl)methoxyiminoacetate

Conditions

Conditions	Yield
With triethylamine In methanol; dichloromethane for 8h;	75.2%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 2,4,6-triazido-4-isopropyl-3-methylcyclohexa-2,5-dien-1-one

Conditions

Conditions	Yield
With Amberlyst A26-resin bound iodine azide In acetonitrile at 20℃; for 2h; Catalytic behavior; Inert atmosphere;	75%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 100-07-2
4-methoxy-benzoyl chloride

: 129375-07-1
3-methyl-4-(1-methylethyl)phenyl 4-methoxybenzoate

Conditions

Conditions	Yield
With pyridine	74%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 257622-59-6
methyl 3-(2-bromoacetamido)benzoate

: 430470-37-4
methyl 3-[2-(4-isopropyl-3-methyl-phenoxy)-acetylamino]-benzoate

Conditions

Conditions	Yield
With potassium carbonate In butanone for 12h; Heating / reflux;	73%
With potassium carbonate In butanone for 12h; Heating / reflux;	73%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 73568-25-9
2-chloro-3-quinoline carboxaldehyde

: 2-(4-isopropyl-3-methylphenoxy)quinoline-3-carbaldehyde

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 150℃;	72%

: 3228-02-2
3-Methyl-4-isopropylphenol

: (+/-)-4-Fluoro-4-isopropyl-3-methylcyclohexa-2,5-dienone

Conditions

Conditions	Yield
With Selectfluor In acetonitrile at 22℃; for 7h; Fluorination;	71%

: 3228-02-2
3-Methyl-4-isopropylphenol

: 143815-14-9
2-bromo-5-methyl-4-(1-methylethyl)phenol

Conditions

Conditions	Yield
With bromine In tetrachloromethane; diethyl ether	70%

: 75-91-2
tert.-butylhydroperoxide

: 3228-02-2
3-Methyl-4-isopropylphenol

: 142260-70-6
1-(tert-butylperoxy)-1,2-benziodoxol-3(1H)-one

: 4-(tert-butylperoxy)-4-isopropyl-3-methyl-2,5-cyclohexadien-1-one

Conditions

Conditions	Yield
In ethyl acetate at 50℃; for 5.5h;	70%

...Expand

: 3228-02-2
3-Methyl-4-isopropylphenol

: 98437-49-1
1,3-bis(bromomethyl)-4-nitrophenol

: 193359-91-0
2,6-bis(2-hydroxy-4-methyl-5-isopropylbenzyl)-4-nitrophenol

Conditions

Conditions	Yield
In acetic acid at 90℃; for 5h;	65%

4-Isopropyl-3-methylphenol Specification

The IUPAC name of 4-Isopropyl-3-methylphenol is 3-methyl-4-propan-2-ylphenol. With the CAS registry number 3228-02-2, it is also named as 1-Hydroxy-3-methyl-4-isopropylbenzene; o-Cymen-5y-ol. The product's categories are organic building blocks, oxygen compounds and phenols. It is white needle crystal which is used as preservative and fungicides in cream cosmetic. Solubility at room temperature are approximately: 36% in ethanol, 65% in methanol, 50% in isopropyl alcohol, 32% in butanol, acetone in 65%, and insoluble in water.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 3.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.28; (4)ACD/LogD (pH 7.4): 3.28; (5)ACD/BCF (pH 5.5): 183.42; (6)ACD/BCF (pH 7.4): 183.22; (7)ACD/KOC (pH 5.5): 1451.38; (8)ACD/KOC (pH 7.4): 1449.8; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.523; (13)Molar Refractivity: 47.14 cm³; (14)Molar Volume: 154.2 cm³; (15)Polarizability: 18.68×10^-24 cm³; (16)Surface Tension: 34.9 dyne/cm; (17)Enthalpy of Vaporization: 48.97 kJ/mol; (18)Vapour Pressure: 0.0358 mmHg at 25°C; (19)Rotatable Bond Count: 1; (20)Tautomer Count: 9; (21)Exact Mass: 150.104465; (22)MonoIsotopic Mass: 150.104465; (23)Topological Polar Surface Area: 20.2; (24)Heavy Atom Count: 11

Uses of 4-Isopropyl-3-methylphenol: It can react with 2-chloro-2-methyl-propane to get 2-tert-Butyl-4-isopropyl-5-methyl-phenol. This reaction is at temperature of 80 - 85 °C. The reaction time is 24 hours. The yield is 90%.

2. It also can react with formaldehyde to obtain 2-hydroxymethyl-4-isopropyl-5-methyl-phenol. This reaction needs reagent NaOH and solvent H₂O at Ambient temperature. The reaction time is 1.5 hours. The yield is 45%.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1. SMILES: Oc1cc(c(cc1)C(C)C)C;
2. InChI: InChI=1/C10H14O/c1-7(2)10-5-4-9(11)6-8(10)3/h4-7,11H,1-3H3.

The following is the toxicity data which has been tested.

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	6280mg/kg (6280mg/kg)	PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	Osaka Shiritsu Daigaku Igaku Zasshi. Journal of the Osaka City Medical Center. Vol. 5, Pg. 111, 1956.
mouse	LD50	subcutaneous	184mg/kg (184mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) SKIN AND APPENDAGES (SKIN): HAIR: OTHER	Osaka Shiritsu Daigaku Igaku Zasshi. Journal of the Osaka City Medical Center. Vol. 5, Pg. 111, 1956.

Product Name

4-ISOPROPYL-3-METHYLPHENOL

Synthetic route

4-Isopropyl-3-methylphenol Specification

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