Cas no 41230-21-1 (3-(1,3-benzothiazol-2-yl)aniline)

3-(1,3-benzothiazol-2-yl)aniline structure
41230-21-1 structure
Product Name:3-(1,3-benzothiazol-2-yl)aniline
CAS No:41230-21-1
MF:C13H10N2S
MW:226.296901226044
MDL:MFCD00579111
CID:331806
PubChem ID:720999
Update Time:2025-04-19

3-(1,3-benzothiazol-2-yl)aniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine,3-(2-benzothiazolyl)-
    • 3-(1,3-Benzothiazol-2-yl)Aniline
    • 3-(2-Benzothiazolyl)aniline
    • 3-(2-benzothiazolyl)-benzenamin
    • 3-Benzothiazol-2-yl-phenylamine
    • m-aminophenylbenzothiazole
    • 3-(benzothiazol-2-yl) benzenamine
    • AKOS000104441
    • HMS2325J11
    • MLS000529265
    • DTXSID40352196
    • BDBM49385
    • SMR000121740
    • AB00076707-01
    • [3-(1,3-benzothiazol-2-yl)phenyl]amine
    • F0347-4603
    • Cambridge id 5250055
    • EN300-02528
    • Z57441719
    • CBDivE_013051
    • CHEMBL1538854
    • AS-60758
    • F82297
    • SCHEMBL2242693
    • BB 0245160
    • 3-(benzo[d]thiazol-2-yl)aniline
    • HMS1614O11
    • cid_720999
    • 41230-21-1
    • MFCD00579111
    • BBL000248
    • STK345883
    • 3-(1,3-benzothiazol-2-yl)aniline
    • MDL: MFCD00579111
    • Inchi: 1S/C13H10N2S/c14-10-5-3-4-9(8-10)13-15-11-6-1-2-7-12(11)16-13/h1-8H,14H2
    • InChI Key: MKMRZZJJDIBAJF-UHFFFAOYSA-N
    • SMILES: S1C2C=CC=CC=2N=C1C1C=CC=C(C=1)N

Computed Properties

  • Exact Mass: 226.05600
  • Monoisotopic Mass: 226.05646950g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 246
  • 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: 3.6
  • Topological Polar Surface Area: 67.2?2

Experimental Properties

  • Melting Point: 135-137℃
  • Water Partition Coefficient: Sparingly soluble in water.(0.26 g/L) (25°C),
  • PSA: 67.15000
  • LogP: 4.12670

3-(1,3-benzothiazol-2-yl)aniline Security Information

  • RTECS:CX9852800
  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

3-(1,3-benzothiazol-2-yl)aniline Customs Data

  • HS CODE:2934200090
  • Customs Data:

    China Customs Code:

    2934200090

    Overview:

    2934200090. Other compounds containing a benzothiazole ring. 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:

    2934200090. other compounds containing in the structure a benzothiazole ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-(1,3-benzothiazol-2-yl)aniline Pricemore >>

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