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Home > Amines > 100795-25-3

100795-25-3

100795-25-3 | 6-Quinolinecarboxylic acid, 4-amino-2-methyl-, ethyl ester

CAS No: 100795-25-3 Catalog No: AG0002W8 MDL No:

Product Description

Catalog Number:
AG0002W8
Chemical Name:
6-Quinolinecarboxylic acid, 4-amino-2-methyl-, ethyl ester
CAS Number:
100795-25-3
Molecular Formula:
C13H14N2O2
Molecular Weight:
230.2625
IUPAC Name:
ethyl 4-amino-2-methylquinoline-6-carboxylate
InChI:
InChI=1S/C13H14N2O2/c1-3-17-13(16)9-4-5-12-10(7-9)11(14)6-8(2)15-12/h4-7H,3H2,1-2H3,(H2,14,15)
InChI Key:
COTZCHZLPFDMPA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2c(c1)c(N)cc(n2)C

Properties

Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.106g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.267g/mol
Monoisotopic Mass:
230.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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