Cas no 14123-76-3 (6-Chloro-3-methylisoquinoline)

6-Chloro-3-methylisoquinoline structure
6-Chloro-3-methylisoquinoline structure
Product Name:6-Chloro-3-methylisoquinoline
CAS No:14123-76-3
MF:C10H8ClN
MW:177.630221366882
MDL:MFCD11110658
CID:120165
PubChem ID:20616787
Update Time:2025-04-18

6-Chloro-3-methylisoquinoline Chemical and Physical Properties

Names and Identifiers

    • 6-Chloro-3-methylisoquinoline
    • 3-Methyl-6-chloroisoquinoline
    • Isoquinoline,6-chloro-3-methyl-
    • 3-Methyl-6-chlorisochinolin
    • 6-chloro-3-methyl-isoquinoline
    • Isoquinoline,6-chloro-3-methyl
    • QC-9388
    • Isoquinoline, 6-chloro-3-methyl-
    • VLPNHJHAQSABQP-UHFFFAOYSA-N
    • FCH889082
    • 6863AA
    • AB0097770
    • AX8108815
    • C72624
    • DTXSID30609106
    • A846916
    • SY279288
    • MFCD11110658
    • DS-16286
    • SCHEMBL1028024
    • AKOS006309565
    • EN300-398319
    • 14123-76-3
    • CS-0130066
    • MDL: MFCD11110658
    • Inchi: 1S/C10H8ClN/c1-7-4-9-5-10(11)3-2-8(9)6-12-7/h2-6H,1H3
    • InChI Key: VLPNHJHAQSABQP-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2=CN=C(C)C=C2C=1

Computed Properties

  • Exact Mass: 177.03500
  • Monoisotopic Mass: 177.0345270g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 160
  • 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: 3.3
  • Topological Polar Surface Area: 12.9

Experimental Properties

  • Density: 1.225±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Very slightly soluble (0.21 g/l) (25 o C),
  • PSA: 12.89000
  • LogP: 3.19660

6-Chloro-3-methylisoquinoline Security Information

6-Chloro-3-methylisoquinoline Customs Data

  • HS CODE:2933499090
  • Customs Data:

    China Customs Code:

    2933499090

    Overview:

    2933499090. Other compounds containing quinoline or isoquinoline ring system [but not further fused]. 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, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933499090. other compounds containing in the structure a quinoline or isoquinoline 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%

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