Cas no 13307-75-0 (Lithium, [(phenylthio)methyl]-)

Lithium, [(phenylthio)methyl]- structure
13307-75-0 structure
Product Name:Lithium, [(phenylthio)methyl]-
CAS No:13307-75-0
MF:C7H7LiS
MW:130.136480569839
CID:1236634
PubChem ID:10909598
Update Time:2025-04-20

Lithium, [(phenylthio)methyl]- Chemical and Physical Properties

Names and Identifiers

    • Lithium, [(phenylthio)methyl]-
    • lithium,methanidylsulfanylbenzene
    • Phenylmercaptomethyl-lithium
    • phenylsulfanylmethyl-lithium
    • 13307-75-0
    • Phenylthiomethyl lithium
    • (phenylthio) methyllithium
    • phenylthiomethyllithium
    • QAHPMEROKBCURL-UHFFFAOYSA-N
    • DTXSID70447943
    • SCHEMBL8014099
    • Inchi: 1S/C7H7S.Li/c1-8-7-5-3-2-4-6-7;/h2-6H,1H2;/q-1;+1
    • InChI Key: PEVVNTJHQRSIIP-UHFFFAOYSA-N
    • SMILES: S([CH2-])C1C=CC=CC=1.[Li+]

Computed Properties

  • Exact Mass: 130.04300
  • Monoisotopic Mass: 130.04284983g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 59.9
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: nothing
  • Tautomer Count: nothing
  • Surface Charge: 0
  • Topological Polar Surface Area: 25.3?2

Experimental Properties

  • PSA: 25.30000
  • LogP: 2.57030
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