Home Halogens 4-Isoquinolinecarboxylic acid, 8-chloro-

4-Isoquinolinecarboxylic acid, 8-chloro-

CAS No.:
1824065-62-4
Catalog Number:
AG0023UW
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
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Product Description
Catalog Number:
AG0023UW
Chemical Name:
4-Isoquinolinecarboxylic acid, 8-chloro-
CAS Number:
1824065-62-4
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
MDL Number:
MFCD28133481
IUPAC Name:
8-chloroisoquinoline-4-carboxylic acid
InChI:
InChI=1S/C10H6ClNO2/c11-9-3-1-2-6-7(9)4-12-5-8(6)10(13)14/h1-5H,(H,13,14)
InChI Key:
LBEGXYDMCQMRPE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc2c1cccc2Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.009g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.613g/mol
Monoisotopic Mass:
207.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties