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80947-25-7 | 4-Amino-2-chloroquinoline
CAS No: 80947-25-7 Catalog No: AG0036GA MDL No:MFCD08705643
Product Description
Catalog Number:
AG0036GA
Chemical Name:
4-Amino-2-chloroquinoline
CAS Number:
80947-25-7
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
MDL Number:
MFCD08705643
IUPAC Name:
2-chloroquinolin-4-amine
InChI:
InChI=1S/C9H7ClN2/c10-9-5-7(11)6-3-1-2-4-8(6)12-9/h1-5H,(H2,11,12)
InChI Key:
QVCRGJALYOLXDC-UHFFFAOYSA-N
SMILES:
Clc1cc(N)c2c(n1)cccc2
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.03g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.619g/mol
Monoisotopic Mass:
178.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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