Products Categories
| CAS No.: | 54423-47-1 |
|---|---|
| Name: | (3aR,4S,5R,6aS)-hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one |
| Molecular Structure: | |
|
|
|
| Formula: | C8H12O4 |
| Molecular Weight: | 172.181 |
| Synonyms: | (1S,6S,5R,7R)-7-Hydroxy-6-(hydroxymethyl)-2-oxabicyclo[3.3.0]octan-3-one; |
| Density: | 1.365 g/cm3 |
| Boiling Point: | 406.6 °C at 760 mmHg |
| Flash Point: | 172.9 °C |
| PSA: | 66.76000 |
| LogP: | -0.70880 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 548773-13-32-amino-4,6-dimethylpyrimidine-5-carboxylic acid
What can I do for you?
Get Best Price
Specification
The (±)-Corey lactone diol, with the CAS registry number of 54423-47-1, is also known as (1S,6S,5R,7R)-7-Hydroxy-6-(hydroxymethyl)-2-oxabicyclo[3.3.0]octan-3-one. This chemical's molecular formula is C8H12O4 and molecular weight is 174.0. What's more, its systematic name is (3aR,4S,5R,6aS)-5-Hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one.
Physical properties about the (±)-Corey lactone diol are: (1)ACD/LogP: -2.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.18; (4)ACD/LogD (pH 7.4): -2.18; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.56; (8)ACD/KOC (pH 7.4): 1.56; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.545; (14)Molar Refractivity: 39.88 cm3; (15)Molar Volume: 126 cm3; (16)Surface Tension: 54.6 dyne/cm; (17)Density: 1.365 g/cm3; (18)Flash Point: 172.9 °C; (19)Enthalpy of Vaporization: 76.08 kJ/mol; (20)Boiling Point: 406.6 °C at 760 mmHg; (21)Vapour Pressure: 2.63E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C1O[C@H]2C[C@@H](O)[C@H](CO)[C@H]2C1
(2) InChI: InChI=1/C8H12O4/c9-3-5-4-1-8(11)12-7(4)2-6(5)10/h4-7,9-10H,1-3H2/t4-,5-,6-,7+/m1/s1
(3) InChIKey: VYTZWRCSPHQSFX-GBNDHIKLBR