14-Methylpregn-4-ene-3,20-dione

Base Information

• Chemical Name: 14-Methylpregn-4-ene-3,20-dione
• CAS No.: 55162-96-4
• Molecular Formula: C22H32O2
• Molecular Weight: 328.4883
• NSC Number: 76615
• DSSTox Substance ID: DTXSID30970505
• Nikkaji Number: J128.009K
• Wikidata: Q82953709
• Mol file: 55162-96-4.mol

Synonyms:55162-96-4;14-Methylpregn-4-ene-3,20-dione;NSC76615;Pregn-4-ene-3,20-dione, 14-methyl-;Pregn-4-ene-3, 14-methyl-;SCHEMBL20251324;DTXSID30970505;YSLKWPPYLOYLMM-VTJFTLGMSA-N;NSC-76615;14-Methylpregn-4-ene-3,20-dione #

Chemical Property of 14-Methylpregn-4-ene-3,20-dione

Chemical Property:

• Vapor Pressure: 3.21E-08mmHg at 25°C
• Boiling Point: 448°Cat760mmHg
• Flash Point: 167°C
• PSA: 34.14000
• Density: 1.07g/cm³
• LogP: 5.11360
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 328.240230259
• Heavy Atom Count: 24
• Complexity: 632

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1CCC2(C1(CCC3C2CCC4=CC(=O)CCC34C)C)C
• Isomeric SMILES: CC(=O)[C@H]1CC[C@@]2([C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)C