chempirical

2-Hydroxycyclohexanecarboxylic acid

C7H12O3CAS 609-69-8144.17 g/mol

Open in Covalent MOL file
OHOHO
AlcoholCarboxylic acid

Properties

Molecular formula
C7H12O3
Molar mass
144.17 g/mol
Exact mass
144.0786 Da
Melting point
111 °C
logP
0.62Crippen estimate
Polar surface area
57.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
609-69-8
SMILES
O=C(O)C1CCCCC1O
InChIKey
SNKAANHOVFZAMR-UHFFFAOYSA-N
InChI
InChI=1S/C7H12O3/c8-6-4-2-1-3-5(6)7(9)10/h5-6,8H,1-4H2,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Cyclohexanecarboxylic acid, 2-hydroxy-
  • Cyclohexanol-2-carboxylic acid
  • Hexahydrosalicylic acid

Work with 2-Hydroxycyclohexanecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2-Cyclohexanedicarboxylic acid1687-30-570 % similar (±)-trans-1,2-Cyclohexanedicarboxylic acid2305-32-070 % similar cis-1,2-Cyclohexanedicarboxylic acid610-09-370 % similar trans-1,2-Cyclopentanedicarboxylic acid1461-97-863 % similar (±)-trans-1,2-Cyclobutanedicarboxylic acid1124-13-654 % similar Cyclopentanecarboxylic acid3400-45-150 % similar Cycloheptanecarboxylic acid1460-16-848 % similar Cyclohexanecarboxylic acid98-89-548 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl 3-ethoxy-2-propenoate1001-26-9 Methyl tetrahydropyran-4-carboxylate110238-91-0 4-(2-Hydroxypropoxy)-2-butyn-1-ol1606-79-7 Ethyl tetrahydrofuroate16874-34-3 4-Hydroxycyclohexanecarboxylic acid17419-81-7 Ethyl 3-methyl-2-oxobutanoate20201-24-5 4-Hydroxybutyl acrylate2478-10-6 Polyethylene glycol methyl ether methacrylate26915-72-0

Elsewhere

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