17a-Methyl-1-testosterone

Chemical Properties

Melting point	162-168 °C(lit.)
Boiling point	422.7±45.0 °C(Predicted)
Density	1.082
solubility	H₂O: ≤0.5 mg/mL
form	solid (photosensitive)
pka	15.14±0.60(Predicted)
color	white
InChI	InChI=1/C20H30O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,13,15-17,22H,4-5,7-8,10-12H2,1-3H3/t13-,15+,16-,17-,18-,19-,20-/s3
InChIKey	JRNSSSJKIGAFCT-PHHVUGHDNA-N
SMILES	[C@@]12([H])CC[C@@]3([H])CC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@](CC[C@@]21[H])(O)C \|&1:0,4,11,13,17,19,22,r\|
CAS DataBase Reference	65-04-3(CAS DataBase Reference)

Hazard Codes	T
Risk Statements	45-63
Safety Statements	53-36/37-45
WGK Germany	3
RTECS	BV8400000
DEA Controlled Substances	CSCN: 4000 CSA SCH: Schedule III NARC: No