17-Hydroxy-13,17-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
Basic information
- CAS
514-61-4- Standard SMILES
CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C- InChIKey
ZXSWTMLNIIZPET-UHFFFAOYSA-N- Molecular formula
- C19H28O2
- Average molar mass
- 288.4 g/mol
- Monoisotopic mass
- 288.20893013
Names & identifiers
- Preferred name
- 17-Hydroxy-13,17-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
- IUPAC
- 17-hydroxy-13,17-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
- English name
- Normethisterone
- Molecular formula
- C19H28O2
- Molecular weight
- 288.42
Names & synonyms
Normethanedrolone17.alpha.-MethylestrenoloneEstr-4-en-3-one, 17.beta.-hydroxy-17-methyl-17-hydroxy-13,17-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one17.alpha.-Methyl-17.beta.-hydroxy-19-nor-4-androsten-3-oneSCHEMBL148632Estr-4-en-3-one,17-hydroxy-17-methyl-, (17b)-CHEMBL476284417.beta.-Methyl-19-nortestosteroneAKOS030242355Estr-4-en-3-one, 17.alpha.-hydroxy-17-methyl-methylnortestosterone
Show more names
NSC-10039OrgastronmetalutinmethalutinorgasteronNORETHANDRONEnormetandroneNORMETHANDRONENORMETHISTERONE
Database identifiers
- CAS
514-61-4- PubChem CID
- 222940
- ChEMBL
CHEMBL4762844
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 508
Physicochemical properties
- Melting point
- 153 · 153-158°C
- alpha
- 33 ° · D +33°
- Boiling point
- 370.65 °C · 370.65°C (rough estimate)
- Density
- 1.0484 · 1.0484 (rough estimate)
- refractive index
- 1.4709 · 1.4709 (estimate)
- storage temp.
- -20 °C · Controlled Substance, -20°C Freezer
- solubility
- 1 mg/ml; · Acetonitrile: 1 mg/ml; Ethanol: 1 mg/ml; Methanol: 1 mg/ml
- form
- A crystalline solid
- pka
- 15.13 · 15.13±0.40(Predicted)
- CAS DataBase Reference
- 514 · 514-61-4(CAS DataBase Reference)
- FDA UNII
- 743 F1Z557A · 743F1Z557A
- ATC code
- 3 DC31 · G03DC31
- Symbol(GHS)
- 8 · GHS08,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H360-H312-H351-H332
- Precautionary statements
- 201 · P201-P202-P281-P308+P313-P405-P501-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
- HS Code
- 29372900 · 29372900
- DEA Controlled Substances
- 4000 CSA · CSCN: 4000CSA SCH: Schedule IIINARC: No
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 29372900
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS07
- Hazard statements
- H302-H360-H312-H351-H332
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
- DEA Controlled Substances
- CSCN: 4000CSA SCH: Schedule IIINARC: No
Chemistry & industry
Applications
UsesAndrogen. Controlled substance (anabolic steroid).
Upstream & downstream products
Downstream products
Additional notes
DefinitionChEBI: Normethandrolone is a steroid. It has a role as an estrogen.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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