• Name

  Butanoic acid,(2E)-3,7-dimethyl-2,6-octadien-1-yl ester

• EINECS 203-381-3
• CAS No. 106-29-6
• Article Data13
• CAS DataBase
• Density 0.898 g/cm³
• Solubility 712.7μg/L at 25℃
• Melting Point
• Formula C₁₄H₂₄O₂
• Boiling Point 299.906 °C at 760 mmHg
• Molecular Weight 224.343
• Flash Point 99.404 °C
• Transport Information
• Appearance colourless to pale yellow liquid/fruity, rose-like odour
• Safety 26-36
• Risk Codes 36/37/38
• Molecular Structure
• Hazard Symbols Xi
• Synonyms Butanoicacid, (2E)-3,7-dimethyl-2,6-octadienyl ester (9CI);Butanoic acid,3,7-dimethyl-2,6-octadienyl ester, (E)-;Butyric acid,3,7-dimethyl-2,6-octadienyl ester, (E)- (8CI);Butyric acid, geranyl ester(6CI);2,6-Octadien-1-ol, 3,7-dimethyl-, butyrate, (E)- (8CI);AG 76;Geraniolbutyrate;Geranyl butanoate;Geranyl n-butyrate;NSC 46146;NSC 70177;trans-3,7-Dimethyl-2,6-octadien-1-yl butyrate;
• PSA 26.30000
• LogP 4.02240

Synthetic route

106-24-1

Geraniol

107-92-6

butyric acid

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With Candida antarctica lipase B at 50℃; for 4h; Molecular sieve; Ionic liquid; Green chemistry; Enzymatic reaction;	99.9%
With sodium hydroxide at 80℃; for 8h;	66.94%
In hexane at 30℃; for 72h; Corynebacterium sp. S-401;	23%

123-73-9

trans-Crotonaldehyde

106-24-1

Geraniol

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With 2-mesityl-2,5,6,7-tetrahydropyrrolo[2,1-c][1,2,4]triazol-4-ium; N-ethyl-N,N-diisopropylamine In tetrahydrofuran at 60℃; for 24h;	63%

106-31-0

butanoic acid anhydride

106-24-1

Geraniol

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With camphor-10-sulfonic acid

123-72-8

butyraldehyde

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With aluminium compound of geraniol

106-24-1

Geraniol

141-75-3

butyryl chloride

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With pyridine
With pyridine at 20℃; Esterification;

106-31-0

butanoic acid anhydride

106-25-2

Nerol

A

106-29-6

Geranyl butyrate

B

999-40-6

butyric acid β-neryl ester

Conditions

Conditions	Yield
With lipase from hog pancreas In diethyl ether at 20℃; for 2h; Product distribution; Rate constant;

...Expand

123-72-8

butyraldehyde

aluminium compound of geraniol

aluminium compound of geraniol

A

109-21-7

butyl butyrate

B

106-29-6

Geranyl butyrate

C

71-36-3

butan-1-ol

D

geranic acid butyl ester

geranic acid butyl ester

Conditions

Conditions	Yield
Produkt5:Geraniumsaeuregeranylester;

...Expand

64-17-5

ethanol

106-24-1

Geraniol

555-75-9

aluminum ethoxide

A

109-21-7

butyl butyrate

B

106-29-6

Geranyl butyrate

C

71-36-3

butan-1-ol

D

geranic acid butyl ester

geranic acid butyl ester

Conditions

Conditions	Yield
destilliert den Alkohol im Vakuum ab und kocht mit Butyraldehyd; Produkt 5: Geraniumsaeuregeranylester;

...Expand

106-24-1

Geraniol

105-54-4

butanoic acid ethyl ester

106-29-6

Geranyl butyrate

Conditions

Conditions	Yield
With recombinant acyltransferase from Mycobacterium smegmatis In aq. phosphate buffer at 25℃; for 48h; pH=8; Green chemistry; Enzymatic reaction;

106-29-6

Geranyl butyrate

8-Hydroxy-2,6-dimethyl-2(E),6(E)-octadienal 8-butyrate

Conditions

Conditions	Yield
With selenium(IV) oxide In 1,4-dioxane; water Oxidation;

106-29-6

Geranyl butyrate

9-Hydroxygeranyl butyrate

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: SeO2 / H2O; dioxane 2: NaBH4 / ethanol / 1 h / 20 °C View Scheme

106-29-6

Geranyl butyrate

2,6-Dimethyl-2(E),6(E)-octadien-1,8-diol 1-acetate 8-butyrate

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: SeO2 / H2O; dioxane 2: NaBH4 / ethanol / 1 h / 20 °C 3: pyridine / 20 °C View Scheme

Geranyl butyrate Chemical Properties

Geranyl butyrate Uses

Geranyl butyrate Production

Geranyl butyrate Toxicity Data With Reference

Geranyl butyrate Consensus Reports

Geranyl butyrate Safety Profile