3-aminonaphthalene-1-carboxylic acid

3-aminonaphthalene-1-carboxylic acid

CAS: 32018-86-3

Formula: C11H9NO2

SMILES: NC1=CC2=CC=CC=C2C(=C1)C(O)=O

IUPAC: 3-aminonaphthalene-1-carboxylic acid

InChI: InChI=1S/C11H9NO2/c12-8-5-7-3-1-2-4-9(7)10(6-8)11(13)14/h1-6H,12H2,(H,13,14)

Composition: C (70.58%), H (4.85%), N (7.48%), O (17.09%)

Molar Mass: 187.198

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	187.063328534
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YIPRQTYMJYGRER-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.46
Topological Polar Surface Area	63.32
Polarizability	21.3
Ring Count	2
Rotatable Bond Count	1

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