3-Amino-3-(3,4-dimethoxyphenyl)propanoic acid
Properties
- Molecular formula
- C11H15NO4
- Molar mass
- 225.24 g/mol
- Exact mass
- 225.1001 Da
- logP
- 1.18Crippen estimate
- Polar surface area
- 81.8 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 5
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
34840-85-2SMILES
COC1=C(C=C(C=C1)C(CC(=O)O)N)OCInChIKey
FGCXSFRGPCUBPW-UHFFFAOYSA-NInChI
InChI=1S/C11H15NO4/c1-15-9-4-3-7(5-10(9)16-2)8(12)6-11(13)14/h3-5,8H,6,12H2,1-2H3,(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3-Amino-3-(3,4-dimethoxy-phenyl)-propionic acid
Work with 3-Amino-3-(3,4-dimethoxyphenyl)propanoic acid
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
3-Amino-3-benzo[1,3]dioxol-5-yl-propionic acid72071-75-169 % similar
(S)-3-Amino-3-(4-methoxy-phenyl)-propionic acid131690-56-768 % similar
(R)-3-Amino-3-(4-methoxy-phenyl)-propionic acid131690-57-868 % similar
3-Amino-3-(4-methoxyphenyl)propanoic acid5678-45-568 % similar
3-Amino-3-(3-methoxyphenyl)propionic acid68208-19-566 % similar
3-Amino-3-(4-methylphenyl)propanoic acid68208-18-457 % similar
3-Amino-3-(3,4-dichloro-phenyl)-propionic acid117391-57-857 % similar
3-Amino-3-(3-methylphenyl)propanoic acid68208-17-356 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds