D-Idose supplier | CasNO.5978-95-0

Name
D-Idose
EINECS 227-780-7
CAS No. 5978-95-0
Article Data86
CAS DataBase
Density 1.581 g/cm³
Solubility
Melting Point
Formula C₆H₁₂O₆
Boiling Point 527.1 °C at 760 mmHg
Molecular Weight 180.158
Flash Point 286.7 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Idose, D-(8CI);
PSA 110.38000
LogP -3.22140

Synthetic route

: 96613-89-7
1-deoxy-1-nitro-D-ido-hexitol

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With sodium hydroxide; sulfuric acid In water at 10 - 20℃; for 1h;	68%

: 504-29-0
2-aminopyridine

: 3615-56-3
D-Sorbose

A: 5978-95-0
D-idose

B: 4205-23-6
D-gulose

Conditions

Conditions	Yield
Stage #1: D-Sorbose With 2-aminopyridine; acetic acid at 90℃; Lobry de Bruyn-van Ekenstein transformation; Sealed tube; Stage #2: 2-aminopyridine With acetic acid at 90℃; Sealed tube; Stage #3: With trifluoroacetic acid at 70℃; for 1h;	A 10% B 16%

...Expand

: 16299-15-3
1,2,3,4,6,-penta-O-acetyl-α-D-idopyranose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With methanol; barium dihydroxide

: 41847-67-0
α-D-idofuranose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 40461-75-4
β-D-idofuranose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 7283-02-5
β-D-idopyranose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 7282-82-8
α-D-idopyranose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 59-23-4
D-Galactose

A: 50-99-7
D-glucose

B: 2595-98-4
D-talose

C: 5978-95-0
D-idose

D: 4205-23-6
D-gulose

Conditions

Conditions	Yield
With 4-methylmorpholine N-oxide at 110℃; Product distribution;

...Expand

: 58-86-6
D-xylose

hydroxylamine hydrochloride: hydroxylamine hydrochloride

: 5978-95-0
D-idose

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 75 percent / Na / methanol / 16 h / 20 °C 2: 68 percent / 1M NaOH, 8M H2SO4 / H2O / 1 h / 10 - 20 °C View Scheme

: 6763-34-4
D-xylose

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With potassium cyanide

: C12H20O6

: 5978-95-0
D-idose

Conditions

Conditions	Yield
With DOWEX50WX8-200 at 20℃; for 24h;	400 mg

: 2033-24-1
cycl-isopropylidene malonate

: 5978-95-0
D-idose

: 315202-41-6
3,6-anhydro-2-deoxy-D-glycero-L-ido-octono-1,4-lactone

Conditions

Conditions	Yield
With tert-butylamine In N,N-dimethyl-formamide at 40℃; for 120h; Substitution; cyclization;	75%

: 590-28-3
potassium cyanate

: 5978-95-0
D-idose

: β-D-idofuranosylamine 1,2-(cyclic carbamate)

Conditions

Conditions	Yield
With sodium dihydrogenphosphate at 60℃; for 2h;	60%

: 5978-95-0
D-idose

: 67-47-0
5-hydroxymethyl-2-furfuraldehyde

Conditions

Conditions	Yield
With magnesium(II) chloride hexahydrate; 2-carboxyphenylboronic acid In N,N-dimethyl acetamide at 105℃; for 4h; Reagent/catalyst; Time;	48%

: 5978-95-0
D-idose

: 75-08-1
ethanethiol

: 158513-65-6
D-idose diethyl dithioacetal

Conditions

Conditions	Yield
With hydrogenchloride at 0℃; for 1h;	34%

: 75-52-5
nitromethane

: 5978-95-0
D-idose

A: 130930-38-0
7-deoxy-7-nitro-D-glycero-L-galacto-heptitol

B: 82916-52-7
7-deoxy-7-nitro-L-glycero-L-galacto-heptitol

Conditions

Conditions	Yield
With sodium methylate In methanol; dimethyl sulfoxide for 20h;

...Expand

: 5978-95-0
D-idose

: 685-27-8
2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide

: 622-33-3
N-benzyloxyamine

A: 128613-75-2
trifluoroacetylated idose-anti-O-benzyloxime

B: 128613-86-5
trifluoroacetylated idose-syn-O-benzyloxime

Conditions

Conditions	Yield
1.) NMP, 75 deg C, 30 min, 2.) NMP, RT, 3 h; Multistep reaction;

...Expand

: 5978-95-0
D-idose

: 25878-23-3
D-iditol

Conditions

Conditions	Yield
With sodium tetrahydroborate

: 5978-95-0
D-idose

: 41847-67-0
α-D-idofuranose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 5978-95-0
D-idose

: 40461-75-4
β-D-idofuranose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 5978-95-0
D-idose

: 7283-02-5
β-D-idopyranose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 5978-95-0
D-idose

: 7282-82-8
α-D-idopyranose

Conditions

Conditions	Yield
With potassium chloride In water-d2 at 40℃; Rate constant; pH 2 (HCl);

: 5978-95-0
D-idose

: 3615-56-3
D-Sorbose

Conditions

Conditions	Yield
With potassium hydroxide In water at 25℃; for 336h; Product distribution; Kinetics;

: 5978-95-0
D-idose

: 67-68-5
dimethyl sulfoxide

A: 2-oxo-propionaldehyde (Z)-radical anion

B: 2-oxo-propionaldehyde (E)-radical anion

C: 16469-89-9
trans-2,3-butane semidione radical anion

Conditions

Conditions	Yield
With tetra(n-butyl)ammonium hydroxide Mechanism; Ambient temperature;

...Expand

: 67-62-9
O-Methylhydroxylamin

: 5978-95-0
D-idose

: 18156-74-6
1-(Trimethylsilyl)imidazole

A: 128705-72-6
trimethylsilyl ether of idose anti-O-methyloxime

B: 128705-63-5
trimethylsilyl ether of idose syn-O-methyloxime

Conditions

Conditions	Yield
1.) NMP, 75 deg C, 30 min, 2.) NMP, RT, 5-10 min; Multistep reaction;

...Expand

: 5978-95-0
D-idose

: 622-33-3
N-benzyloxyamine

: 18156-74-6
1-(Trimethylsilyl)imidazole

: 128614-14-2
trimethylsilyl ether of idose anti-O-benzyloxime

Conditions

Conditions	Yield
1.) NMP, 75 deg C, 30 min, 2.) NMP, RT, 5-10 min; Multistep reaction;

...Expand

: 5978-95-0
D-idose

: 576-42-1, 18404-47-2, 18404-62-1, 36439-43-7, 84864-60-8, 84878-11-5
potassium D-idarate

Conditions

Conditions	Yield
With nitric acid; potassium carbonate 1.) heating.; Yield given. Multistep reaction;

: 5978-95-0
D-idose

: 7664-93-9
sulfuric acid

: 10339-42-1
levoglucosan

Conditions

Conditions	Yield
Gleichgewicht;

: 5978-95-0
D-idose

: D-idose hydrazone

Conditions

Conditions	Yield
With hydrazine at 20℃; for 16h; Condensation;

D-Idose Specification

The D-Idose, with the CAS registry number 5978-95-0, is also known as D-Ido-hexose. Its EINECS registry number is 227-780-7. This chemical's molecular formula is C₆H₁₂O₆ and molecular weight is 180.1559. Its systematic name is called D-idose .

Physical properties of D-Idose: (1)ACD/LogP: -3.17; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -3.17; (4)ACD/LogD (pH 7.4): -3.17; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 10; (12)Index of Refraction: 1.573; (13)Molar Refractivity: 37.54 cm³; (14)Molar Volume: 113.9 cm³; (15)Surface Tension: 92 dyne/cm; (16)Density: 1.581 g/cm³; (17)Flash Point: 286.7 °C; (18)Enthalpy of Vaporization: 92.22 kJ/mol; (19)Boiling Point: 527.1 °C at 760 mmHg; (20)Vapour Pressure: 2.59E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)CO
(2)InChI: InChI=1/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4-,5+,6+/m1/s1
(3)InChIKey: GZCGUPFRVQAUEE-ZXXMMSQZBN

Product Name

D-Idose

Synthetic route

D-Idose Specification

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