Cypionic acid
Properties
- Molecular formula
- C8H14O2
- Molar mass
- 142.20 g/mol
- Exact mass
- 142.0994 Da
- Density
- 1.01 g/mL (at 17.4 °C)
- Melting point
- 131 °C
- Boiling point
- 130–132 °C
- logP
- 2.04Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98% of notifiers
Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
140-77-2SMILES
O=C(O)CCC1CCCC1InChIKey
ZRPLANDPDWYOMZ-UHFFFAOYSA-NInChI
InChI=1S/C8H14O2/c9-8(10)6-5-7-3-1-2-4-7/h7H,1-6H2,(H,9,10)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
6 names
- Cyclopentanepropanoic acid
- Cyclopentanepropionic acid
- 3-Cyclopentylpropionic acid
- Cyclopentylpropionic acid
- 3-Cyclopentylpropanoic acid
- NSC 8771
Work with Cypionic 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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Cyclohexanepropanoic acid701-97-395 % similar
Cyclohexanebutanoic acid4441-63-878 % similar
Cyclopentaneacetic acid1123-00-863 % similar
4-Ethyloctanoic acid16493-80-460 % similar
Cyclohexaneacetic acid5292-21-760 % similar
Glutaric acid110-94-155 % similar
Adipic acid124-04-955 % similar
4-Methylpentanoic acid646-07-154 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.
Same formula
γ-Octalactone104-50-7
1-Methylcyclohexanecarboxylic acid1123-25-7
1-Acetylcyclohexanol1123-27-9
trans-4-Methylcyclohexanecarboxylic acid13064-83-0
tert-Butyl 3-butenoate14036-55-6
2,5-Dimethyl-3-hexyne-2,5-diol142-30-3
Cycloheptanecarboxylic acid1460-16-8
2,2,3,3-Tetramethylcyclopropanecarboxylic acid15641-58-4