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Home > Encyclopedia > Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI)

Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI)

Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI) structure

Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI) 

structure
  • CAS No:

    775322-46-8

  • Formula:

    C13H13NO2

  • Chemical Name:

    Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI)

  • Synonyms:

    3-(2,4-dimethyl-1H-pyrrol-3-yl)benzoic acid;SCHEMBL5413929;ZINC45809134;3-(2,4-dimethyl-1H-pyrrol-3-yl)-benzoic acid

Benzoic acid, 3-(2,4-dimethyl-1H-pyrrol-3-yl)- (9CI) Basic Attributes

215.24782

215.095

Characteristics

53.1

2.6

Computed Properties

Molecular Weight:215.25
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:215.094628657
Monoisotopic Mass:215.094628657
Topological Polar Surface Area:53.1
Heavy Atom Count:16
Complexity:267
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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