Cas no 536974-76-2 (2-bromo-4-(hydroxymethyl)phenyl benzoate)

2-bromo-4-(hydroxymethyl)phenyl benzoate structure
536974-76-2 structure
Product Name:2-bromo-4-(hydroxymethyl)phenyl benzoate
CAS No:536974-76-2
MF:C14H11BrO3
MW:307.139343500137
CID:938991
PubChem ID:11088108
Update Time:2025-04-19

2-bromo-4-(hydroxymethyl)phenyl benzoate Chemical and Physical Properties

Names and Identifiers

    • 2-bromo-4-(hydroxymethyl)phenyl benzoate
    • [2-bromo-4-(hydroxymethyl)phenyl] benzoate
    • 3-bromo-4-benzoyloxybenzyl alcohol
    • DTXSID20454804
    • 536974-76-2
    • SCHEMBL3236453
    • Inchi： 1S/C14H11BrO3/c15-12-8-10(9-16)6-7-13(12)18-14(17)11-4-2-1-3-5-11/h1-8,16H,9H2
    • InChI Key： MSRBJLBMCNHNND-UHFFFAOYSA-N
    • SMILES： OCC1C=C(Br)C(OC(C2C=CC=CC=2)=O)=CC=1

Computed Properties

  • Exact Mass: 305.98900
  • Monoisotopic Mass: 305.98916g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 276
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53000
  • LogP: 3.16060

2-bromo-4-(hydroxymethyl)phenyl benzoate Customs Data

  • HS CODE：2916310090
  • Customs Data：

    China Customs Code:

    2916310090

    Overview:

    2916310090 Other benzoic acids and their salts and esters. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods) MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    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:

    2916310090 other benzoic acid and its salts and esters.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:6.5%.general tariff:30.0%

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