(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-octoxy-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol

Base Information

• Chemical Name: (5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-octoxy-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
• CAS No.: 1252-02-4
• Molecular Formula: C27H46 O2
• Molecular Weight: 402.65
• NSC Number: 75533
• Nikkaji Number: J7.474H
• Mol file: 1252-02-4.mol

Synonyms:1252-02-4;(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-octoxy-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol;5alpha-Androst-2-en-17beta-ol, 3-(octyloxy)-;Dihydrotestosterone n-octyl enol ether;NSC75533;5.alpha.-Androst-2-en-17.beta.-ol, 3-(octyloxy)-;NSC-75533

Chemical Property of (5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-octoxy-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol

Chemical Property:

• Vapor Pressure: 1.58E-12mmHg at 25°C
• Boiling Point: 509.8°Cat760mmHg
• Flash Point: 207.6°C
• PSA: 29.46000
• Density: 1.01g/cm³
• LogP: 7.26090
• XLogP3: 8.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 402.349780706
• Heavy Atom Count: 29
• Complexity: 583

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC1=CCC2(C(C1)CCC3C2CCC4(C3CCC4O)C)C
• Isomeric SMILES: CCCCCCCCOC1=CC[C@]2([C@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C)C