C22H27ClO2

Base Information

• Chemical Name: C22H27ClO2
• CAS No.: 7548-44-9
• Molecular Formula: C22H27ClO2
• Molecular Weight: 358.94
• NSC Number: 84053
• DSSTox Substance ID: DTXSID40996938
• Nikkaji Number: J59.371K
• Wikidata: Q82988858

Synonyms:BDH 2700;7548-44-9;DTXSID40996938;NSC84053;NSC-84053;21-Chloro-3,17-dimethoxy-19-norpregna-1(10),2,4-trien-20-yne;19-Nor-17.alpha.-pregna-1,5(10)-trien-20-yne, 21-chloro-3,17-dimethoxy-;19-Norpregna-1,5(10)-trien-20-yne, 21-chloro-3,17-dimethoxy-, (17.alpha.)-

Chemical Property of C22H27ClO2

Chemical Property:

• Vapor Pressure: 5.56E-08mmHg at 25°C
• Refractive Index: 1.5330 (estimate)
• Boiling Point: 453.4°C at 760 mmHg
• Flash Point: 139.2°C
• PSA: 18.46000
• Density: 1.18g/cm³
• LogP: 5.13620
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 358.1699578
• Heavy Atom Count: 25
• Complexity: 577

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2(C#CCl)OC)CCC4=C3C=CC(=C4)OC
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#CCl)OC)CCC4=C3C=CC(=C4)OC

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