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(3b,14b)-Androst-5-en-3-ol

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Name

(3b,14b)-Androst-5-en-3-ol

EINECS N/A
CAS No. 163061-08-3 Density 1.05g/cm3
PSA 20.23000 LogP 4.70020
Solubility N/A Melting Point N/A
Formula C19H30O Boiling Point 387.1 °C at 760 mmHg
Molecular Weight 274.44 Flash Point 160.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 163061-08-3 ((3b,14b)-Androst-5-en-3-ol) Hazard Symbols N/A
Synonyms

(3b,14b)-Androst-5-en-3-ol;Androst-5-en-3-ol, (3β,14β)-

 

(3b,14b)-Androst-5-en-3-ol Specification

The (3β,14β)-Androst-5-en-3-ol, with CAS registry number 163061-08-3, has the systematic name of androst-5-en-3-ol, (3beta,14beta)-. Its molecular weight is 274.44. And the chemical formula of this chemical is C19H30O.

Physical properties of (3β,14β)-Androst-5-en-3-ol: (1)ACD/LogP: 6.01; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.01; (4)ACD/LogD (pH 7.4): 6.01; (5)ACD/BCF (pH 5.5): 21624.69; (6)ACD/BCF (pH 7.4): 21624.69; (7)ACD/KOC (pH 5.5): 44110.62; (8)ACD/KOC (pH 7.4): 44110.62; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 82.99 cm3; (15)Molar Volume: 260 cm3; (16)Polarizability: 32.9×10-24cm3; (17)Surface Tension: 41.1 dyne/cm; (18)Density: 1.05 g/cm3; (19)Flash Point: 160.3 °C; (20)Enthalpy of Vaporization: 73.56 kJ/mol; (21)Boiling Point: 387.1 °C at 760 mmHg; (22)Vapour Pressure: 1.37E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@@]12CCC[C@@H]1[C@@H]3CC=C4C[C@H](CC[C@@]4([C@H]3CC2)C)O
(2)InChI: InChI=1/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h5,14-17,20H,3-4,6-12H2,1-2H3/t14-,15-,16+,17-,18-,19-/m0/s1
(3)InChIKey: LYFPAZBMEUSVNA-XEZGLNCPBK
(4)Std. InChI: InChI=1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h5,14-17,20H,3-4,6-12H2,1-2H3/t14-,15-,16+,17-,18-,19-/m0/s1
(5)Std. InChIKey: LYFPAZBMEUSVNA-XEZGLNCPSA-N

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