Cas no 6294-84-4 (2-carbamoylcyclohexane-1-carboxylic acid)

2-Carbamoylcyclohexane-1-carboxylic acid is a cyclohexane derivative featuring both carbamoyl and carboxylic acid functional groups, making it a versatile intermediate in organic synthesis and pharmaceutical applications. Its rigid cyclohexane backbone provides structural stability, while the functional groups enable further derivatization, such as amidation or esterification. This compound is particularly useful in the synthesis of bioactive molecules, including peptidomimetics and chiral building blocks, due to its stereochemical flexibility. The presence of both polar and non-polar moieties enhances its solubility in a range of solvents, facilitating reaction optimization. Its well-defined reactivity profile ensures consistent performance in multi-step synthetic routes.
2-carbamoylcyclohexane-1-carboxylic acid structure
6294-84-4 structure
Product Name:2-carbamoylcyclohexane-1-carboxylic acid
CAS No:6294-84-4
MF:C8H13NO3
MW:171.193722486496
MDL:MFCD00177934
CID:884329
PubChem ID:223767
Update Time:2026-04-29

2-carbamoylcyclohexane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-carbamoylcyclohexanecarboxylic acid
    • (+-)-cis-
    • (+-)-cis-2-Carbamoyl-cyclohexancarbonsaeure
    • (2Z)-4-(allyloxy)but-2-en-1-ol
    • (E)-4-prop-2-enoxybut-2-en-1-ol
    • (Z)-but-2-en-1-ol
    • 2-Buten-1-ol, 4-(2-propenyloxy)-, (Z)-
    • 5-oxa-2,7-octadiene-1-ol
    • ACMC-20m8jc
    • allyl 4-hydroxy-cis-2-buten-1-yl ether
    • cis-2-butene-1,4-diol monoallyl ether
    • cis-2-Carboxamidocyclohexanecarboxylic acid
    • cis-4-(allyloxy)but-2-en-1-ol
    • cis-hexahydrophtalamic acid
    • 2-carbamoylcyclohexane-1-carboxylic acid
    • MDL: MFCD00177934

Computed Properties

  • Exact Mass: 171.08959
  • Monoisotopic Mass: 171.09
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 203
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0

Experimental Properties

  • Density: 1.248
  • Boiling Point: 427.6°C at 760 mmHg
  • Flash Point: 212.4°C
  • Refractive Index: 1.522
  • PSA: 80.39
  • LogP: 1.06300

2-carbamoylcyclohexane-1-carboxylic acid Pricemore >>

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