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methyl 6-aminonaphthalene-2-carboxylate

methyl 6-aminonaphthalene-2-carboxylate

CAS: 5159-59-1

Formula: C12H11NO2

SMILES: COC(=O)C1=CC2=CC=C(N)C=C2C=C1

IUPAC: methyl 6-aminonaphthalene-2-carboxylate

InChI: InChI=1S/C12H11NO2/c1-15-12(14)10-3-2-9-7-11(13)5-4-8(9)6-10/h2-7H,13H2,1H3

Composition: C (71.63%), H (5.51%), N (6.96%), O (15.90%)

Molar Mass: 201.225

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 201.078978598
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LPXVPYIHRFOTJZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.23
Topological Polar Surface Area 52.32
Polarizability 23.41
Ring Count 2
Rotatable Bond Count 2

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