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2-amino-4-methoxybenzoic acid

2-amino-4-methoxybenzoic acid

CAS: 4294-95-5

Formula: C8H9NO3

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

IUPAC: 2-amino-4-methoxybenzoic acid

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

Composition: C (57.48%), H (5.43%), N (8.38%), O (28.71%)

Molar Mass: 167.164

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 167.058243154
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey HHNWXQCVWVVVQZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.48
Topological Polar Surface Area 72.55
Polarizability 16.36
Ring Count 1
Rotatable Bond Count 2

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95% <10 Days 4294-95-5 $54.74-$164.22$54.74$84.07$164.22
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