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C14H20N2O4CAS 70671-54-4280.32 g/mol

OOHNNH2OHO
CarbamateCarboxylic acidPrimary amine

Properties

Molecular formula
C14H20N2O4
Molar mass
280.32 g/mol
Exact mass
280.1423 Da
logP
1.50Crippen estimate
Polar surface area
101.6 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
8
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Identifiers

CAS number
70671-54-4
SMILES
C1=CC=C(C=C1)COC(=O)N[C@H](CCCCN)C(=O)O
InChIKey
OJTJKAUNOLVMDX-GFCCVEGCSA-N
InChI
InChI=1S/C14H20N2O4/c15-9-5-4-8-12(13(17)18)16-14(19)20-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,15H2,(H,16,19)(H,17,18)/t12-/m1/s1

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Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere