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Home > Encyclopedia > S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate

S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate

S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate structure

S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate 

structure
  • CAS No:

    64408-99-7

  • Formula:

    C21H23NOS

  • Chemical Name:

    S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate

  • Synonyms:

    Benzenecarbothioic acid,4-heptyl-,S-(4-cyanophenyl) ester;S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate;4-Cyanophenyl 4-n-heptylthiobenzoate

S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate Basic Attributes

337.5 g/mol

337.48

DTXSID3070094

Characteristics

66.2 Ų

S-(4-Cyanophenyl) 4-heptylbenzenecarbothioate Use and Manufacturing

Benzenecarbothioic acid, 4-heptyl-, S-(4-cyanophenyl) ester: INACTIVE

Computed Properties

Molecular Weight:337.5
XLogP3:7.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:337.15003553
Monoisotopic Mass:337.15003553
Topological Polar Surface Area:66.2
Heavy Atom Count:24
Complexity:411
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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