Products for Research Use Only
RegisterLogin

Estr-4-en-17-one

CAT: 0572-TRC-E889085-10MGSize: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-E889085-10MGSize:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
3646-28-4
Synonyms
Estrenone; Allylestrenol Impurity A;
Hazard Statement
No Data Available
Smiles
C[C@@]12[C@](CCC2=O)([H])[C@@]3([H])[C@@](CC1)([H])[C@]4([H])C(CC3)=CCCC4
Molecular Formula
C18H26O
Molecular Weight
258.4
InChI
InChI=1S/C18H26O/c1-18-11-10-14-13-5-3-2-4-12(13)6-7-15(14)16(18)8-9-17(18)19/h4,13-16H,2-3,5-11H2,1H3/t13-,14+,15+,16-,18-/m0/s1
Additionnal Information
IUPAC name: (8R,9S,10R,13S,14S)-13-methyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one
Shipping Conditions
Room Temperature

Chemical Information

Estr-4-en-17-one
CAS Number3646-28-4
PubChem CID107437
IUPAC Name(8R,9S,10R,13S,14S)-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one
Molecular FormulaC18H26O
Molecular Weight258.4
XLogP4
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity435
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CCCC[C@H]34
InChI
InChI=1S/C18H26O/c1-18-11-10-14-13-5-3-2-4-12(13)6-7-15(14)16(18)8-9-17(18)19/h4,13-16H,2-3,5-11H2,1H3/t13-,14+,15+,16-,18-/m0/s1
InChIKey
OLYAEHZZXXLNQQ-QXUSFIETSA-N
Chemical Structure
2D Structure
2D structure of Estr-4-en-17-one
CAS: 3646-28-4
CID: 107437
Formula: C18H26O
MW: 258.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.4
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass258.198365449
Monoisotopic Mass258.198365449
Topological Polar Surface Area17.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity435
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-E668645-10MG(17Beta)-Estr-4-en-17-ol
TRC-E668645-50MG(17b)-Estr-4-en-17-ol
TRC-E668645-25MG(17Beta)-Estr-4-en-17-ol
TRC-H942095-25MG(3alpha,5beta)-3-Hydroxy-estr-1-en-17-one
TRC-H942105-25MG(3alpha,5alpha)-3-Hydroxy-estr-1-en-17-one
H95064517-Hydroxypregn-​4-​en-​3-​one
TRC-D595015-100MG(17alpha)-4,17-Dihydroxy-17-methylandrost-4-en-3-one
TRC-M350655-250MG(13Alpha)-17-Methyleneandrost-4-en-3-one
TRC-M350655-100MG(13Alpha)-17-Methyleneandrost-4-en-3-one
TRC-M350655-500MG(13a)-17-Methyleneandrost-4-en-3-one

Alternative Products

CatalogName
DAA64628-01Estr-4-en-17-one
412303-01(17β) ​-Estr-​4-​en-​17-​ol
278320-0117- (2-Propenyl) estr-4-en-17-ol
41222117α-Hydroxy-5β-estr-1-en-3-one
428224(3α,5β) -3-​Hydroxy-estr-​1-​en-​17-​one
AKB57363(7 alpha, 17 beta) -17- (Acetyloxy) -7- (9-bromononyl) estr-4-en-3-one
412153-0117-Hydroxypregn-​4-​en-​3-​one
MBS579656317-hydroxyestr-4-en-3-one
BAA2359717-Hydroxypregn-4-en-3-one
HY-108952-0117,17- (Ethylenedioxy) androst-4-en-3-one

Popular Products