Products 85-95-0

CAS 85-95-0 appears in our catalog under these names: Benzoestrol, >95% (HPLC), Benzoestrol. Offered by: TRC, Dr. Ehrenstorfer, Biosynth. Available pack sizes: 10mg, 25mg, 5mg, 2mg.

Benzoestrol, >95% (HPLC)
TRC
  • size: 10mg, 25mg, 5mg
  • Variants: 3
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Benzoestrol
Dr. Ehrenstorfer, Biosynth
  • size: 5mg, 2mg, 10mg, 25mg
  • Variants: 5
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Structural formula: {0} (CAS {1})

Benzestrol is a phenylpropanoid.

Source: ChEBI

Identity
Molecular formulaC20H26O2
Molecular weight298.4 g/mol
IUPAC name4-[3-ethyl-4-(4-hydroxyphenyl)hexan-2-yl]phenol
InChIKeyDUTFBSAKKUNBAL-UHFFFAOYSA-N
SMILESCCC(C1=CC=C(C=C1)O)C(CC)C(C)C2=CC=C(C=C2)O

Computed by PubChem (NCBI)

Synonyms: BENZESTROL, Benzestrolo, Benzestrolum, Octoestrolum, Bencestrol, 4,4'-(1,2-Diethyl-3-methyl-1,3-propanediyl)bisphenol, Octestrol, Benzoestrol, Chemestrogen, 4-[3-ethyl-4-(4-hydroxyphenyl)hexan-2-yl]phenol
Isomers (same molecular formula)
1-butoxy-4-(4-butoxyphenyl)benzene C20H26O2
4-[2-(4-hydroxy-3,5-dimethylphenyl)butan-2-yl]-2,6-dimethylphenol C20H26O2
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(13S,14S,17S)-13-ethyl-3-methoxy-6,7,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-ol C20H26O2
(8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-6-methylidene-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-3-one C20H26O2
(8R,9S,10R,13S,14S)-10,13-dimethyl-6-methylidene-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione C20H26O2
(8S,9S,10R,14S)-13-ethyl-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione C20H26O2
(8R,9S,10R,13S,14S,17S)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(8R,9S,13S,14S)-13-ethyl-3-methoxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one C20H26O2
(8R,9S,10R,13S,14S,17S)-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxirane]-3-one C20H26O2
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(8R,9R,10S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2