chempirical

1-Aminocyclohexanecarboxylic acid

C7H13NO2CAS 2756-85-6143.19 g/mol

Open in Covalent MOL file
H2NOHO
Carboxylic acidPrimary amine

Properties

Molecular formula
C7H13NO2
Molar mass
143.19 g/mol
Exact mass
143.0946 Da
Melting point
350 °C (decomposes)
logP
0.73Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
2756-85-6
SMILES
NC1(C(=O)O)CCCCC1
InChIKey
WOXWUZCRWJWTRT-UHFFFAOYSA-N
InChI
InChI=1S/C7H13NO2/c8-7(6(9)10)4-2-1-3-5-7/h1-5,8H2,(H,9,10)

Weigh it out

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

Names and synonyms

5 names
  • Cyclohexanecarboxylic acid, 1-amino-
  • α-Aminocyclohexanecarboxylic acid
  • Homocycloleucine
  • 1-Aminocyclohexane-1-carboxylic acid
  • NSC 9059

Work with 1-Aminocyclohexanecarboxylic 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

Cycloleucine52-52-895 % similar 1-Aminocyclobutanecarboxylic acid22264-50-286 % similar 1-Aminocyclopropane-1-carboxylic acid22059-21-877 % similar 1-Aminocyclobutanecarboxylic acid hydrochloride98071-16-076 % similar 1-Amino-1-cyclopropanecarboxylic acid hydrochloride68781-13-571 % similar 3-Aminotetrahydrofuran-3-carboxylic acid125218-55-553 % similar 1-Methylcyclohexanecarboxylic acid1123-25-750 % similar Acpd39026-63-647 % similar

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

Same formula

Ethyl (2E)-3-(dimethylamino)-2-propenoate1117-37-9 Isopropyl β-aminocrotonate14205-46-0 2,2-Diethoxy-1-isocyanoethane15586-32-0 Methyl (3R)-3-piperidinecarboxylate164323-85-7 1,4-Dioxa-8-azaspiro[4.5]decane177-11-7 4-Aminocyclohexanecarboxylic acid1776-53-0 3,3-Diethoxypropionitrile2032-34-0 Dimethylaminoethyl acrylate2439-35-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook