436144-67-1
7-ALPHA-METHYL-ESTRA-4-ENE-3,17-DIONE
Name7-ALPHA-METHYL-ESTRA-4-ENE-3,17-DIONE
1Identification
【Name】
7-ALPHA-METHYL-ESTRA-4-ENE-3,17-DIONE
【CAS】
【MDL】
MFCD00271619
【English Synonyms】
【Formula】
C19 H26 O2
【MolWeight】
286.412
【Inchi】
InChI=1S/C19H26O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h10-11,14-16,18H,3-9H2,1-2H3/t11-,14+,15-,16+,18-,19+/m1/s1
【InChIKey】
InChIKey=IHFREKJAIFEZMQ-ARTWWJDJSA-N
【SMILES】
C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]3[C@@H]1[C@@H]4CCC(=O)[C@]4(CC3)C
【MOL File】
7-ALPHA-METHYL-ESTRA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-ALPHA-METHYL-ESTRA-4-ENE-3,17-DIONE.cml