Home Halogens 8-chloro-4-methylisoquinoline

8-chloro-4-methylisoquinoline

CAS No.:
2120112-95-8
Catalog Number:
AG01EIP0
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
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Product Description
Catalog Number:
AG01EIP0
Chemical Name:
8-chloro-4-methylisoquinoline
CAS Number:
2120112-95-8
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
MDL Number:
MFCD31665705
IUPAC Name:
8-chloro-4-methylisoquinoline
InChI:
InChI=1S/C10H8ClN/c1-7-5-12-6-9-8(7)3-2-4-10(9)11/h2-6H,1H3
InChI Key:
TWCUKERNERYEDZ-UHFFFAOYSA-N
SMILES:
Clc1cccc2c1cncc2C
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