2-Amino-4-methoxybenzoic acid

C₈H₉NO₃CAS 4294-95-5167.16 g/mol

Open in Covalent MOL file

Carboxylic acid Ether Primary amine

Properties

Molecular formula: C₈H₉NO₃
Molar mass: 167.16 g/mol
Exact mass: 167.0582 Da
logP: 0.98Crippen estimate
Polar surface area: 72.5 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Identifiers

CAS number

4294-95-5

SMILES

COC1=CC(=C(C=C1)C(=O)O)N

InChIKey

HHNWXQCVWVVVQZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H9NO3/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)

Weigh it out

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

Names and synonyms

1 names

2-Amino-4-methoxy-benzoic acid

Work with 2-Amino-4-methoxybenzoic 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

4-Methoxyphthalic acid1885-13-875 % similar 4-Methoxysalicylic acid2237-36-771 % similar 2,4-Dimethoxybenzoic acid91-52-171 % similar 2-Chloro-4-methoxybenzoic acid21971-21-167 % similar 2-Fluoro-4-methoxybenzoic acid394-42-367 % similar 2,5-Dimethoxybenzoic acid2785-98-066 % similar 1-(2-Amino-4-methoxyphenyl)ethan-1-one42465-53-265 % similar 5-Methoxysalicylic acid2612-02-464 % similar

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

Same formula

2-(4-Nitrophenyl)ethanol100-27-6 P-Nitrophenetole100-29-8 1-Methoxy-4-methyl-2-nitrobenzene119-10-8 Glycin122-87-2 2-Methoxy-1-methyl-4-nitrobenzene13120-77-9 2,4-Dimethyl-6-nitrophenol14452-34-7 2-Nitrobenzeneethanol15121-84-3 4-Methoxy-1-methyl-2-nitrobenzene17484-36-5

Elsewhere

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