(3b,5b,25S)-Spirostan-3-ol

Catalog No: FT-0686699

CAS No: 126-19-2

Chemical Name: (3b,5b,25S)-Spirostan-3-ol
Molecular Formula: C27H44O3
Molecular Weight: 416.6
InChI Key: GMBQZIIUCVWOCD-WWASVFFGSA-N
InChI: InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 11965 ', '2 . Molar volume （m3/mol）3743 ', '3 . Parachor （902K）9629 ', '4 . Surface tension 438 ', '5 . Polarizability 4743']
LogP:	6.21
Flash_Point:	266.2±21.8 °C
Refractive_Index:	1.552
FW:	416.637
Density:	1.1±0.1 g/cm3
Bolling_Point:	516.6±20.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :65 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 387 ', '7. Heavy Atom Count :30 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :694 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :12 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	194°C
PSA:	38.69000
MF:	C27H44O3
Vapor_Pressure:	0.0±3.0 mmHg at 25°C
Exact_Mass:	416.329041