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CS-W001157 4
Total: USD 88.00

2-Amino-3-methylbenzene-1-thiol

  • CAS No. 76462-17-4

  • Cat. No. CS-0218006
  • Molecule weight139.22
  • Purity98+%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2-Amino-3-methylbenzene-1-thiol|CS-0218006

Structure of 76462-17-4

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General Information

  • CAS No. 76462-17-4
  • Cat. No. CS-0218006
  • Purity 98+%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NS
  • Molecular Weight 139.22
  • Synonym(s) 2-Amino-3-methylbenzenethiol
  • SMILES SC1=CC=CC(C)=C1N

Synthesis

  • Route1

    References

    • Inoue, Hirozumi; Konda, Mikihiko; Hashiyama, Tomiki; Otsuka, Hisao; Watanabe, Akishige; Gaino, Mitsunori; Takahashi, Kaoru; Date, Tadamasa; Okamura, Kimio; Takeda, Mikio; Narita, Hiroshi; Murata, Sakae; Odawara, Akio; Sasaki, Haruhiko; Nagao, Taku Chemical and Pharmaceutical Bulletin, 1997 , vol. 45, # 6 p. 1008 - 1026
  • Route2
    • (2-Methylphenyl)thiourea|CS-0071628
      614-78-8
    • ~%
    • 2-Amino-3-methylbenzene-1-thiol|CS-0218006
      76462-17-4

    References

    • Gupta; Ojha; Kumar Journal of Heterocyclic Chemistry, 1980 , vol. 17, # 6 p. 1325 - 1327
  • Route3

    References

    • Gupta; Ojha; Kumar Journal of Heterocyclic Chemistry, 1980 , vol. 17, # 6 p. 1325 - 1327

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.86592
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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