11β-Chloromethylestradiol

Molecular structure via molpic based on CDK

Conformer []
Conformer structure via JSmol

Physical properties []
Molecular mass	320.9 g/mol [1]
Predicted LogP	4.3 [1]

Structural Identifiers []
Molecular formula	C19H25ClO2 [1]
IUPAC name	(8S,9R,11S,13S,14S,17S)-11-(chloromethyl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol [1]
SMILES	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O)CCl [1]
InChI	InChI=1S/C19H25ClO2/c1-19-9-12(10-20)18-14-5-3-13(21)8-11(14)2-4-15(18)16(19)6-7-17(19)22/h3,5,8,12,15-18,21-22H,2,4,6-7,9-10H2,1H3/t12-,15+,16+,17+,18-,19+/m1/s1 [1]
InChIKey	CADGCTOWBAPSFQ-OQFXVXKWSA-N [1]

11β-Chloromethylestradiol

11β-Chloromethylestradiol (also known as 11-β-chloromethyl-estradiol, 11 β-chloromethylestradiol, 11β-CME2, (11β,17β)-11-(Chloromethyl)estra-1,3,5(10)-triene-3,17-diol, (11β,17β)-11-(chloromethyl)estra-1,3,5(10)-triene-3,17-diol, Org-4333, Org 4333, CME2, 11β-chloromethylestra-1,3,5(10)-trien-3,17β-diol or Estra-1,3,5(10)-triene-3,17-diol, 11-(chloromethyl)-, (11β,17β)-) is a substance of the steroid class.

Chemistry