chempirical

12-Aminododecanoic acid

C12H25NO2CAS 693-57-2215.34 g/mol

Open in Covalent MOL file
H2NOOH
Carboxylic acidPrimary amine

Properties

Molecular formula
C12H25NO2
Molar mass
215.34 g/mol
Exact mass
215.1885 Da
Melting point
184 °C
logP
2.93Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
11

Identifiers

CAS number
693-57-2
SMILES
NCCCCCCCCCCCC(=O)O
InChIKey
PBLZLIFKVPJDCO-UHFFFAOYSA-N
InChI
InChI=1S/C12H25NO2/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11,13H2,(H,14,15)

Weigh it out

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

Names and synonyms

7 names
  • Dodecanoic acid, 12-amino-
  • λ-Aminolauric acid
  • ω-Aminolauric acid
  • 12-Aminolauric acid
  • ω-Aminododecanoic acid
  • ADA
  • 12-Amindodecanoic acid

Work with 12-Aminododecanoic 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

8-Aminooctanoic acid1002-57-9100 % similar 11-Aminoundecanoic acid2432-99-7100 % similar 6-Aminohexanoic acid60-32-2100 % similar 7-Aminoheptanoic acid929-17-9100 % similar 5-Aminovaleric acid660-88-895 % similar 7-Aminoheptanoic acid hydrochloride62643-56-588 % similar 5-Aminovaleric acid hydrochloride627-95-283 % similar Pimelic acid111-16-071 % similar

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

Same formula

Diethyl aminoethyl hexanoate10369-83-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook