trans-4-(Methoxycarbonyl)cyclohexanecarboxylic acid
Properties
- Molecular formula
- C9H14O4
- Molar mass
- 186.21 g/mol
- Exact mass
- 186.0892 Da
- Melting point
- 67.5–68.5 °C
- logP
- 1.05Crippen estimate
- Polar surface area
- 63.6 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
- Stereocentres
- r, rin SMILES atom order
Identifiers
CAS number
15177-67-0SMILES
COC(=O)[C@H]1CC[C@H](C(=O)O)CC1InChIKey
ZQJNPHCQABYENK-LJGSYFOKNA-NInChI
InChI=1/C9H14O4/c1-13-9(12)7-4-2-6(3-5-7)8(10)11/h6-7H,2-5H2,1H3,(H,10,11)/t6-,7-Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 1,4-Cyclohexanedicarboxylic acid, 1-methyl ester, trans-
- 1,4-Cyclohexanedicarboxylic acid, monomethyl ester, trans-
- Monomethyl trans-1,4-cyclohexanedicarboxylate
- trans-1,4-Cyclohexanedicarboxylic acid monomethyl ester
- 1,4-trans-Cyclohexanedicarboxylic acid monomethyl ester
- Monomethyl trans-cyclohexane-1,4-dicarboxylate
- trans-4-Carbomethoxycyclohexane-1-carboxylic acid
Work with trans-4-(Methoxycarbonyl)cyclohexanecarboxylic acid
Similar compounds
Methyl cyclopropanecarboxylate2868-37-372 % similar
1,4-Dimethyl trans-1,4-cyclohexanedicarboxylate3399-22-272 % similar
Dimethyl 1,4-cyclohexanedicarboxylate94-60-072 % similar
Methyl 4-hydroxycyclohexanecarboxylate17449-76-263 % similar
trans-4-tert-Butoxycarbonyl-cyclohexane carboxylic acid1021273-74-461 % similar
1,4-Cyclohexanedicarboxylic acid1076-97-760 % similar
1,4-Cyclohexanedicarboxylic acid619-81-860 % similar
trans-1,4-Cyclohexanedicarboxylic acid619-82-960 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds