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(3alpha,20R)-Pregn-4-Ene-3,20-Diol
[CAS# 60966-95-2]

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CAS#: 60966-95-2
Product: (3alpha,20R)-Pregn-4-Ene-3,20-Diol
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Identification
Name (3alpha,20R)-Pregn-4-Ene-3,20-Diol
Synonyms 4-Pregnene-3-α,20-β-diol
Molecular Structure CAS#: 60966-95-2, (3alpha,20R)-Pregn-4-Ene-3,20-Diol
Molecular Formula C21H34O2
Molecular Weight 318.49
CAS Registry Number 60966-95-2
SMILES C[C@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C[C@@H](CC[C@]34C)O)C)O
InChI 1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12-13,15-19,22-23H,4-11H2,1-3H3/t13-,15-,16+,17-,18+,19+,20+,21-/m1/s1
InChIKey IBMZAHKIAAJREF-ONNYUIQLSA-N
Properties
Density 1.1±0.1g/cm3 (Cal.)
Boiling point 449.5±18.0°C at 760 mmHg (Cal.)
Flash point 199.5±15.8°C (Cal.)
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List of Reports Available for (3alpha,20R)-Pregn-4-Ene-3,20-Diol
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