COC1=C(C=C(C=C1)N)C(=O)OC
CAS: 22802-67-1
Name: methyl 5-amino-2-methoxybenzoate
SMILES: COC1=C(C=C(C=C1)N)C(=O)OC

Molecular Processing

Molecular formula
C9H11NO3
Molecular weight
181.19
Exact mass
181.0739
XLogP
1.06
TPSA
61.55
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.75

Supplementary Information

InChIKey: PSCXCIPPRCFAAO-UHFFFAOYSA-N
Synonyme
22802-67-1Methyl 5-amino-o-anisateEINECS 245-230-4DTXSID50177357RefChem:816878DTXCID7099848245-230-4methyl 5-amino-2-methoxybenzoate5-Amino-2-methoxy-benzoic acid methyl esterMFCD08458835methyl5-amino-2-methoxybenzoate5-amino-2-methoxybenzoic acid methyl esterBenzoic acid, 5-amino-2-methoxy-, methyl esterSCHEMBL570110methyl 2-methoxy-5-aminobenzoateMethyl-2-methoxy-5-aminobenzoatemethyl 5-amino-2-methoxy-benzoate3-methyloxycarbonyl-4-methoxyanilineSBB053737AKOS000297811AB45660FA55657SY239029TS-02532DB-011608CS-0172541NS00027264ST509496912-methoxy-5-amino benzoic acid, methyl esterEN300-250136
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