Basic information
- Name:
dihydro-
- Superlist Name:
- Dihydrovitamin K1
- CAS No.:
572-96-3
- Molecular Structure:
- Formula:
- C31H48O2
- Molecular Weight:
- 452.71
- Synonyms:
- Vitamin K hydroquinone;Phytonadiol;Vitamin K1 hydroquinone;3-methyl-2-[(7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-diol;2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol;(R-(R*,R*-(E)))-2-Methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)naphthalene-1,4-diol;1,4-Naphthalenediol,2-methyl-3-[(2E,7R,- 11R)-3,7,11,15-tetramethyl-2-hexadecenyl]-;3-methyl-2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-diol;
- EINECS:
- 209-344-8
- Density:
- 0.981
- Boiling Point:
- 589.1 °C at 760 mmHg
- Flash Point:
- 239.1 °C
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Specification
Dihydrovitamin K1 belongs to the categories of Various Metabolites and Impurities; Inhibitors; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals. Specifically, this compound is the metabolite of vitamin K1 & vitamin K1 2,3-epoxide . Its IUPAC name is called 2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-diol . And the systematic name is named 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol . The SMILES is short ASCII strings for describing the structure which is Oc2c1ccccc1c(O)c(c2C)C\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C.
The Dihydrovitamin K1 has several physical properties including: (1)H bond acceptors: 2; (2)H bond donors: 2; (3)Freely Rotating Bonds: 16; (4)Index of Refraction: 1.543; (5)Molar Refractivity: 145.4 cm3; (6)Molar Volume: 461.1 cm3; (7)Surface Tension: 38.2 dyne/cm; (8)Enthalpy of Vaporization: 91.17 kJ/mol; (9)Vapour Pressure: 1.79E-14 mmHg at 25°C