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trans-6-methylcyclohex-3-ene-1-carboxylic acid

trans-6-methylcyclohex-3-ene-1-carboxylic acid structure

trans-6-methylcyclohex-3-ene-1-carboxylic acid 

structure
  • CAS No:

    10479-42-2

  • Formula:

    C8H12O2

  • Chemical Name:

    trans-6-methylcyclohex-3-ene-1-carboxylic acid

  • Synonyms:

    trans-6-methylcyclohex-3-ene-1-carboxylic acid;trans-6-Methyl-3-cyclohexene-1-carboxylicacid;trans-6-Methylcyclohex-3-enecarboxylic acid;Trans-3-methyl-3-cyclohexene-1-carboxylic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

trans-6-methylcyclohex-3-ene-1-carboxylic acid Basic Attributes

140.18

140.18

233-978-4

TSCA listed

Characteristics

37.3 Ų

1.062±0.06 g/cm3(Predicted)

64-65 °C(Solv: water (7732-18-5); methanol (67-56-1))

140 °C(Press: 20 Torr)

4.69±0.40(Predicted)

trans-6-methylcyclohex-3-ene-1-carboxylic acid Use and Manufacturing

3-Cyclohexene-1-carboxylic acid, 6-methyl-, (1R,6R)-rel-: ACTIVE

Computed Properties

Molecular Weight:140.18
XLogP3:1.7
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:161
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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