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1-Methyl-3-cyclohexene-1-carboxylic acid

1-Methyl-3-cyclohexene-1-carboxylic acid structure

1-Methyl-3-cyclohexene-1-carboxylic acid 

structure
  • CAS No:

    16646-42-7

  • Formula:

    C8H12O2

  • Chemical Name:

    1-Methyl-3-cyclohexene-1-carboxylic acid

  • Synonyms:

    3-Cyclohexene-1-carboxylic acid,1-methyl-;1-Methyl-3-cyclohexene-1-carboxylic acid;1-Methyl-3-cyclohexenecarboxylic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

1-Methyl-3-cyclohexene-1-carboxylic acid Basic Attributes

140.18000

140.18

2916209090

Characteristics

37.30000

1.81740

0.9945 g/cm3 @ Temp: 20 °C

78-79 °C

75-77 °C @ Press: 18 Torr

111.2ºC

1.494

0.014mmHg at 25°C

Computed Properties

Molecular Weight:140.18
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:140.083729621
Monoisotopic Mass:140.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:172
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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