trans-1,2-Cyclopentanedicarboxylic acid

C7H10O4CAS 1461-97-8158.15 g/mol

OHOOHO
Carboxylic acid

Properties

Molecular formula
C7H10O4
Molar mass
158.15 g/mol
Exact mass
158.0579 Da
Melting point
160–161 °C
Boiling point
46–49 °C (at 110 Torr)
logP
0.57Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2
Stereocentres
S, Sin SMILES atom order

Identifiers

CAS number
1461-97-8
SMILES
O=C(O)[C@H]1CCC[C@@H]1C(=O)O
InChIKey
ASJCSAKCMTWGAH-LXDRQGDMNA-N
InChI
InChI=1/C7H10O4/c8-6(9)4-2-1-3-5(4)7(10)11/h4-5H,1-3H2,(H,8,9)(H,10,11)/t4-,5-/s2

Weigh it out

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

Names and synonyms

4 names
  • 1,2-Cyclopentanedicarboxylic acid, (1R,2R)-rel-
  • trans-1,2-Cyclopentanedioic acid
  • 1,2-Cyclopentanedicarboxylic acid, trans-
  • Rel-(1R,2R)-1,2-Cyclopentanedicarboxylic acid

Work with trans-1,2-Cyclopentanedicarboxylic acid

Similar compounds

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

Same formula

Elsewhere