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Progesterone Impurity 2

CAT: 1596-AR-P02929-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P02929-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
60966-36-1
Synonyms
(8S,9S,10R,13S,14S,17R) -17- ((S) -1-hydroxypropan-2-yl) -10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3 (2H) -one;21-Hydroxy-20-methylpregn-4-en-3-one
Molecular Formula
C22H34O2
Molecular Weight
330.52
API Name
Progesterone

Chemical Information

21-Hydroxy-20-methylpregn-4-en-3-one
CAS Number60966-36-1
PubChem CID6454094
IUPAC Name(8S,9S,10R,13S,14S,17R)-17-(1-hydroxypropan-2-yl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC22H34O2
Molecular Weight330.5
XLogP4.7
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity564
SMILES
CC(CO)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C
InChI
InChI=1S/C22H34O2/c1-14(13-23)18-6-7-19-17-5-4-15-12-16(24)8-10-21(15,2)20(17)9-11-22(18,19)3/h12,14,17-20,23H,4-11,13H2,1-3H3/t14?,17-,18+,19-,20-,21-,22+/m0/s1
InChIKey
ZNWOYQVXPIEQRC-ZRFCQXGJSA-N
Chemical Structure
2D Structure
2D structure of 21-Hydroxy-20-methylpregn-4-en-3-one
CAS: 60966-36-1
CID: 6454094
Formula: C22H34O2
MW: 330.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.5
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass330.255880323
Monoisotopic Mass330.255880323
Topological Polar Surface Area37.3 Ų
Heavy Atom Count24
Formal Charge0
Complexity564
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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