Compound: CYCLOHEXANECARBOXYLIC ACID
SMILES: O=C(O)C1CCCCC1
InChIKey: NZNMSOFKMUBTKW-UHFFFAOYSA-N
Synonyms: CYCLOHEXANECARBOXYLIC ACID, 98-89-5, Hexahydrobenzoic acid, Carboxycyclohexane, Cyclohexanoic acid, Cyclohexylcarboxylic acid, Benzoic acid, hexahydro-, Cyclohexylmethanoic acid, Cyclohexylformic acid, Cyclohexancarbonsaeure, FEMA No. 3531, H9VKD9VL18, NSC-452, DTXSID8059180, CHEBI:36096, RefChem:919389, DTXCID1049063, 202-711-3, Cyclohexane-1-carboxylate, Cyclohexadienecarboxylicacid, Cyclohexane-carboxylic acid, 26764-36-3, MFCD00001461, Cyclohexanecarboxylic acid, lead salt, 50825-29-1, CYCLOHEXANE CARBOXYLIC ACID, Cyclohexanecarboxylicacid, NSC 452, cyclohexyl carboxylic acid, EINECS 202-711-3, UNII-H9VKD9VL18, EPA Pesticide Chemical Code 112603, 1-cyclohexanecarboxylic acid, BRN 0970529, cyclohexane-1-carboxylic acid, naphthenoic acid, AI3-01854, EINECS 256-790-4, hexahydro-benzoic acid, Cyelohexanecarboxylic acid, cyclohexane caboxylic acid, Cyclohexanecarboxylic acid, lead salt (1:?), cyclo-hexanecarboxylic acid, cycloh exanecarboxylic acid, cyclohexancarbons&#xe4;ure, bmse000546, bmse000603, 4-Cyclohexylcarboxylic acid, EC 202-711-3, 4-cyclohexanecarboxylic acid, SCHEMBL6501, 1-cyclohexyl-carboxylic acid, SAMPL4, O6, SCHEMBL49329, cyclohexane-4-carboxylic acid, 4-09-00-00016 (Beilstein Handbook Reference), SCHEMBL231070, SCHEMBL384605, NSC452, orb1909600, SCHEMBL1864575, SCHEMBL1864577, SCHEMBL1868510, SCHEMBL3227707, SCHEMBL7538133, SCHEMBL11758086, SCHEMBL15602824, SCHEMBL19971123, Cyclohexanecarboxylic acid, 98%, FEMA 3531, HY-Y1373R, NZNMSOFKMUBTKW-UHFFFAOYSA-, 7549-42-0 (calcium salt), BDBM197305, CS-D1501, HY-Y1373, STR02844, Cyclohexanecarboxylic acid (Standard), MSK159206, s6279, SBB008550, STL168520, AKOS000119768, CYCLOHEXANECARBOXYLIC ACID [MI], EBC-151030, SB40629, CYCLOHEXANECARBOXYLIC ACID [FHFI], Cyclohexanecarboxylic acid, >=98%, FG, CYCLOHEXANECARBOXYLIC ACID [USP-RS], DB-016117, NS00001343, ST50213876, Cyclohexanecarboxylic acid, analytical standard, EN300-19834, C09822, P17799, F079483, Cyclohexanecarboxylic acid, purum, >=97.0% (GC), Q5198713, F2191-0111, Z104475698, Cyclohexanecarboxylic acid, United States Pharmacopeia (USP) Reference Standard, InChI=1/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)
Theoretical properties:
molecular_formula: C7H12O2
molecular_weight: 128.17 g/mol
exact_mass: 128.083729621 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 1
heavy_atom_count: 9
topological_polar_surface_area: 37.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
boiling_point: 232.00 to 233.00 °C. @ 760.00 mm Hg
melting_point: 31 - 32 °C
density: 1.029-1.037
solubility: 4.6 mg/mL at 25 °C
vapor_pressure: 0.03 [mmHg]
Descriptions:
pubchem: Cyclohexanecarboxylic acid is a monocarboxylic acid that consists of cyclohexane substituted by a carboxy group. It is a conjugate acid of a cyclohexanecarboxylate.
chebi: A monocarboxylic acid that consists of cyclohexane substituted by a carboxy group.
wikipedia: Cyclohexanecarboxylic acid is the organic compound with the formula C6H11CO2H or C6H11COOH. It is the carboxylic acid of cyclohexane.  It is a colorless oil that crystallizes near room temperature.