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Home > Encyclopedia > Benzenecarbothioamide, N-1,3-butadienyl- (9CI)

Benzenecarbothioamide, N-1,3-butadienyl- (9CI)

Benzenecarbothioamide, N-1,3-butadienyl- (9CI) structure

Benzenecarbothioamide, N-1,3-butadienyl- (9CI) 

structure
  • CAS No:

    170937-98-1

  • Formula:

    C11H11NS

  • Chemical Name:

    Benzenecarbothioamide, N-1,3-butadienyl- (9CI)

  • Synonyms:

    N-buta-1,3-dienylbenzenecarbothioamide;CTK4D3759;DTXSID40396055;BENZENECARBOTHIOAMIDE, N-1,3-BUTADIENYL-

Benzenecarbothioamide, N-1,3-butadienyl- (9CI) Basic Attributes

189.27674

189.061

DTXSID40396055

Characteristics

44.1

2.9

1.076±0.06 g/cm3(Predicted)

290.2±23.0 °C(Predicted)

Computed Properties

Molecular Weight:189.28
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:189.06122053
Monoisotopic Mass:189.06122053
Topological Polar Surface Area:44.1
Heavy Atom Count:13
Complexity:202
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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