Cas no 85-95-0 (Benzoestrol)

Benzoestrol structure
Benzoestrol structure
Product Name:Benzoestrol
CAS No:85-95-0
MF:C20H26O2
MW:298.419246196747
CID:722375
PubChem ID:6827
Update Time:2025-04-19

Benzoestrol Chemical and Physical Properties

Names and Identifiers

    • Phenol,4,4'-(1,2-diethyl-3-methyl-1,3-propanediyl)bis-
    • Benzoestrol
    • 4-[3-ethyl-4-(4-hydroxyphenyl)hexan-2-yl]phenol
    • 3-Aethyl-2,4-bis-(4-hydroxy-phenyl)-hexan
    • 3-Aethyl-2,4-bis-(4-hydroxy-phenyl)-hexan,Opt.-inakt. Praeparat vom F: 75grad
    • 3-ethyl-2,4-bis-(4-hydroxy-phenyl)-hexane
    • 4,4'-(1,2-Diethyl-3-methyl-1,3-propanediyl)bisphenol
    • BENZESTROL
    • Benzestrolo
    • Benzestrolum
    • Benzoestrolum
    • Chemestrogen
    • Ocestrol
    • Octoestrol
    • CHEBI:135264
    • DTXSID50861663
    • Benzestrol [USP:INN:BAN]
    • Benzestrolo [DCIT]
    • Octoestrolum
    • 85-95-0
    • 4,4'-(3-Ethylhexane-2,4-diyl)diphenol
    • NSC-408889
    • NSC408889
    • AKOS030254537
    • NS00008953
    • Phenol, 4,4'-(1,2-diethyl-3-methyl-1,3-propanediyl)bis-
    • BENZESTROL [INN]
    • DUTFBSAKKUNBAL-UHFFFAOYSA-N
    • AI3-23191
    • 4,4'-(1,2-Diethyl-3-methyltrimethylene)diphenol
    • Q4890763
    • Benzestrolum [INN-Latin]
    • UNII-A27512LR47
    • BENZESTROL [MI]
    • SCHEMBL554391
    • 4,4'-(3-ETHYL-2,4-HEXANEDIYL)DIPHENOL
    • CHEMBL2104644
    • A27512LR47
    • BENZESTROL [MART.]
    • Octofollin
    • Inchi： 1S/C20H26O2/c1-4-19(14(3)15-6-10-17(21)11-7-15)20(5-2)16-8-12-18(22)13-9-16/h6-14,19-22H,4-5H2,1-3H3
    • InChI Key： DUTFBSAKKUNBAL-UHFFFAOYSA-N
    • SMILES： OC1C=CC(=CC=1)C(CC)C(CC)C(C)C1C=CC(=CC=1)O

Computed Properties

  • Exact Mass: 298.19300
  • Monoisotopic Mass: 298.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 6
  • Complexity: 301
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 6
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Density: 1.0104 (rough estimate)
  • Melting Point: 162-166°
  • Boiling Point: 399.83°C (rough estimate)
  • Refractive Index: 1.5680 (estimate)
  • PSA: 40.46000
  • LogP: 5.42130

Benzoestrol Customs Data

  • HS CODE：2907299090
  • Customs Data：

    China Customs Code:

    2907299090

    Overview:

    2907299090 Other polyphenols,Phenolic alcohol.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    2907299090 polyphenols; phenol-alcohols.supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward).VAT:17.0%.tax rebate rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

Benzoestrol Pricemore >>

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