Home Halogens 8-methyl-6-chloroisoquinoline

8-methyl-6-chloroisoquinoline

CAS No.:
196875-78-2
Catalog Number:
AG01DZ8I
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
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Product Description
Catalog Number:
AG01DZ8I
Chemical Name:
8-methyl-6-chloroisoquinoline
CAS Number:
196875-78-2
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
MDL Number:
MFCD00089596
IUPAC Name:
6-chloro-8-methylisoquinoline
InChI:
InChI=1S/C10H8ClN/c1-7-4-9(11)5-8-2-3-12-6-10(7)8/h2-6H,1H3
InChI Key:
CVTCTTATZILNNT-UHFFFAOYSA-N
SMILES:
Clc1cc2ccncc2c(c1)C
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.631g/mol
Monoisotopic Mass:
177.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties