Home Carboxys 1-Naphthalenecarboxylic acid, 3-amino-, methyl ester

1-Naphthalenecarboxylic acid, 3-amino-, methyl ester

CAS No.:
88790-90-3
Catalog Number:
AG004CYH
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
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Product Description
Catalog Number:
AG004CYH
Chemical Name:
1-Naphthalenecarboxylic acid, 3-amino-, methyl ester
CAS Number:
88790-90-3
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
MDL Number:
MFCD11044995
IUPAC Name:
methyl 3-aminonaphthalene-1-carboxylate
InChI:
InChI=1S/C12H11NO2/c1-15-12(14)11-7-9(13)6-8-4-2-3-5-10(8)11/h2-7H,13H2,1H3
InChI Key:
SXKPYDRBFCWMNT-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)cc2c1cccc2
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties