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1260643-33-1 | 3-Quinolineacetic acid, α-amino-
CAS No: 1260643-33-1 Catalog No: AG000QXE MDL No:
Product Description
Catalog Number:
AG000QXE
Chemical Name:
3-Quinolineacetic acid, α-amino-
CAS Number:
1260643-33-1
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
IUPAC Name:
2-amino-2-quinolin-3-ylacetic acid
InChI:
InChI=1S/C11H10N2O2/c12-10(11(14)15)8-5-7-3-1-2-4-9(7)13-6-8/h1-6,10H,12H2,(H,14,15)
InChI Key:
AXYJMUJCXQQBRU-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1cnc2c(c1)cccc2)N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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