Cas no 1735-12-2 (2-(5-methyl-1-benzothiophen-3-yl)acetic acid)

2-(5-methyl-1-benzothiophen-3-yl)acetic acid structure
1735-12-2 structure
Product Name:2-(5-methyl-1-benzothiophen-3-yl)acetic acid
CAS No:1735-12-2
MF:C11H10O2S
MW:206.260901927948
CID:147758
PubChem ID:121186
Update Time:2025-09-26

2-(5-methyl-1-benzothiophen-3-yl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • Benzo[b]thiophene-3-aceticacid, 5-methyl-
    • (5-Methyl-benzo(b)thiophen-3-yl)acetic acid
    • 2-(5-methyl-1-benzothiophen-3-yl)acetic acid
    • 5-methylBenzo[b]thiophene-3-acetic acid
    • 5-Methyl-benzo<b><3>thienylessigsaeure
    • 5-Methyl-benzo<b>thiophen-3-yl-essigsaeure
    • Fragment 7
    • 2-(5-methylbenzothiophen-3-yl)acetic acid
    • 2-(5-methyl-1-benzothiophen-3-yl)ethanoic acid
    • Benzo[b]thiophene-3-acetic acid, 5-methyl-
    • (5-Methyl-1-benzothien-3-yl)acetic acid
    • HMS1700P03
    • 5-18-06-00472 (Beilstein Handbook Reference)
    • 2-(5-methylbenzo[b]thiophen-3-yl)aceticacid
    • AKOS000505915
    • SCHEMBL1520186
    • CS-0222423
    • AM-944/40947651
    • Benzo(b)thiophene-3-acetic acid, 5-methyl-
    • Z220564772
    • KYZMXUFJGWTSOX-UHFFFAOYSA-N
    • C11H10O2S
    • BAA73512
    • (5-Methyl-1-benzothien-3-yl)acetic acid #
    • (5-Methylbenzo(b)thien-3-yl)acetic acid
    • BDBM81421
    • 2-(5-methylbenzo[b]thiophen-3-yl)acetic acid
    • BRN 1243408
    • EN300-111086
    • F3277-0671
    • 1735-12-2
    • 5-Methylbenzo(b)thiophene-3-acetic acid
    • FT-0715230
    • DTXSID20169623
    • Inchi: 1S/C11H10O2S/c1-7-2-3-10-9(4-7)8(6-14-10)5-11(12)13/h2-4,6H,5H2,1H3,(H,12,13)
    • InChI Key: KYZMXUFJGWTSOX-UHFFFAOYSA-N
    • SMILES: S1C=C(CC(=O)O)C2C=C(C)C=CC1=2

Computed Properties

  • Exact Mass: 206.04000
  • Monoisotopic Mass: 206.04
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 229
  • 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: 2.8
  • Topological Polar Surface Area: 65.5?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Melting Point: Not available
  • Boiling Point: 390.8±27.0 °C at 760 mmHg
  • Flash Point: 190.2±23.7 °C
  • Refractive Index: 1.668
  • PSA: 65.54000
  • LogP: 2.83680
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

2-(5-methyl-1-benzothiophen-3-yl)acetic acid Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-(5-methyl-1-benzothiophen-3-yl)acetic acid Pricemore >>

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