5-alpha-Androstan-3-one, 2-bromo-17-beta-hydroxy-, O-(p-nitrophenyl)oxime, acetate (ester)

Base Information

• Chemical Name: 5-alpha-Androstan-3-one, 2-bromo-17-beta-hydroxy-, O-(p-nitrophenyl)oxime, acetate (ester)
• CAS No.: 33510-44-0
• Molecular Formula: C27H35BrN2O5
• Molecular Weight: 547.4812
• Mol file: 33510-44-0.mol

Synonyms:5-alpha-Androstan-3-one, 2-bromo-17-beta-hydroxy-, O-(p-nitrophenyl)oxime, acetate (ester);2-Bromo-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime acetate (ester);C27H35BrN2O5;C27-H35-Br-N2-O5;33510-44-0;LS-19380

Chemical Property of 5-alpha-Androstan-3-one, 2-bromo-17-beta-hydroxy-, O-(p-nitrophenyl)oxime, acetate (ester)

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 596.7°Cat760mmHg
• Flash Point: 314.7°C
• PSA: 93.71000
• Density: 1.49g/cm³
• LogP: 7.20060
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 546.17293
• Heavy Atom Count: 35
• Complexity: 868

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1CCC2C1(CCC3C2CCC4C3(CC(C(=NOC5=CC=C(C=C5)[N+](=O)[O-])C4)Br)C)C
• Isomeric SMILES: CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC(/C(=N/OC5=CC=C(C=C5)[N+](=O)[O-])/C4)Br)C)C