chempirical

Formestane

C19H26O3CAS 566-48-3302.41 g/mol

Open in Covalent MOL file
OOHO
AlkeneKetone

Properties

Molecular formula
C19H26O3
Molar mass
302.41 g/mol
Exact mass
302.1882 Da
Melting point
199–202 °C
logP
3.97Crippen estimate
Polar surface area
54.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0
Stereocentres
R, R, S, S, Sin SMILES atom order

Hazards

Danger
Health Hazard (GHS08)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number
566-48-3
SMILES
C[C@]12CCC(=O)C(O)=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12
InChIKey
OSVMTWJCGUFAOD-KZQROQTASA-N
InChI
InChI=1S/C19H26O3/c1-18-10-8-15(20)17(22)14(18)4-3-11-12-5-6-16(21)19(12,2)9-7-13(11)18/h11-13,22H,3-10H2,1-2H3/t11-,12-,13-,18+,19-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • Androst-4-ene-3,17-dione, 4-hydroxy-
  • 4-Hydroxyandrost-4-ene-3,17-dione
  • CGP 32349
  • 4-Hydroxyandrostenedione
  • 4-Hydroxyandrostene-3,17-dione
  • Lentaron
  • 4-OHA
  • CRC 82/01
  • 4-HAD
  • NSC 282175

Work with Formestane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Oxymesterone145-12-064 % similar Androstenedione63-05-854 % similar 4-Dehydroepiandrosterone571-44-853 % similar Androst-4-ene-3,6,17-trione2243-06-351 % similar 1-Androstene-3B-ol,17-one76822-24-747 % similar Epiandrosterone481-29-847 % similar Androsterone53-41-847 % similar Etiocholanolone53-42-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(+)-trans-Allethrin28434-00-6 (4-(Methoxymethyl)phenyl)methyl 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)cyclopropanecarboxylate34388-29-9 2-Methoxyestradiol362-07-2 19-Hydroxyandrostenedione510-64-5 9Alpha-Hydroxyandrost-4-ene-3,17-dione560-62-3 7-Keto-dehydroepiandrosterone566-19-8 Allethrin584-79-2 Allethrin84030-86-4

Elsewhere

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