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Home >> Chemical Listing >> Page 2558 >> (20S)-20-Aminopregna-1,4-dien-3-one

(20S)-20-Aminopregna-1,4-dien-3-one
[CAS# 77546-81-7]

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Identification
Name (20S)-20-Aminopregna-1,4-dien-3-one
Molecular Structure CAS#: 77546-81-7, (20S)-20-Aminopregna-1,4-dien-3-one
Molecular Formula C21H31NO
Molecular Weight 313.48
CAS Registry Number 77546-81-7
EINECS 278-720-1
SMILES CC(N)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
InChI 1S/C21H31NO/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h8,10,12-13,16-19H,4-7,9,11,22H2,1-3H3/t13?,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey BQUZWOTWZGCUID-HWSYHKBZSA-N
Properties
Density 1.083g/cm3 (Cal.)
Boiling point 445.797°C at 760 mmHg (Cal.)
Flash point 223.41°C (Cal.)
Market Analysis Reports
List of Reports Available for (20S)-20-Aminopregna-1,4-dien-3-one
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