Cas no 57182-70-4 (2,4-dimethylbenzene-1-carbothioamide)

2,4-dimethylbenzene-1-carbothioamide structure
57182-70-4 structure
Product Name:2,4-dimethylbenzene-1-carbothioamide
CAS No:57182-70-4
MF:C9H11NS
MW:165.25534081459
CID:1602549
PubChem ID:2517680
Update Time:2025-04-21

2,4-dimethylbenzene-1-carbothioamide Chemical and Physical Properties

Names and Identifiers

    • 2,4-dimethylbenzenecarbothioamide
    • Z85918833
    • G35450
    • 2,4-Dimethylbenzothioamide
    • CHEMBL1579121
    • 2,4-dimethylthiobenzamide
    • HMS2386K11
    • MLS000058505
    • UQGIEZGCCUAUGR-UHFFFAOYSA-N
    • SMR000068028
    • AKOS008987474
    • cid_2517680
    • BDBM87649
    • MFCD06386700
    • SCHEMBL10147428
    • DTXSID00368874
    • STL302000
    • HMS1764O13
    • 2,4-dimethylbenzene-1-carbothioamide
    • 57182-70-4
    • EN300-12256
    • CS-0225072
    • Inchi: 1S/C9H11NS/c1-6-3-4-8(9(10)11)7(2)5-6/h3-5H,1-2H3,(H2,10,11)
    • InChI Key: UQGIEZGCCUAUGR-UHFFFAOYSA-N
    • SMILES: S=C(C1C=CC(C)=CC=1C)N

Computed Properties

  • Exact Mass: 165.06133
  • Monoisotopic Mass: 165.06122053g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 156
  • 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: 2.1
  • Topological Polar Surface Area: 58.1?2

Experimental Properties

  • PSA: 26.02

2,4-dimethylbenzene-1-carbothioamide Security Information

2,4-dimethylbenzene-1-carbothioamide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B431025-50mg
2,4-dimethylbenzene-1-carbothioamide
57182-70-4
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$ 50.00 2022-06-07
TRC
B431025-100mg
2,4-dimethylbenzene-1-carbothioamide
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$ 95.00 2022-06-07
TRC
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$ 320.00 2022-06-07
Enamine
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$64.0 2023-06-12
Enamine
EN300-12256-0.1g
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$66.0 2023-06-12
Enamine
EN300-12256-0.25g
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Enamine
EN300-12256-0.5g
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$175.0 2023-06-12
Enamine
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$256.0 2023-06-12
Enamine
EN300-12256-2.5g
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$503.0 2023-06-12
Enamine
EN300-12256-5.0g
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