Home Halogens Isoquinoline, 1-chloro-5-methoxy-

Isoquinoline, 1-chloro-5-methoxy-

CAS No.:
106462-85-5
Catalog Number:
AG007UY1
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
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Product Description
Catalog Number:
AG007UY1
Chemical Name:
Isoquinoline, 1-chloro-5-methoxy-
CAS Number:
106462-85-5
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
MDL Number:
MFCD11846291
IUPAC Name:
1-chloro-5-methoxyisoquinoline
InChI:
InChI=1S/C10H8ClNO/c1-13-9-4-2-3-8-7(9)5-6-12-10(8)11/h2-6H,1H3
InChI Key:
DVHOIKSDQCZHOV-UHFFFAOYSA-N
SMILES:
COc1cccc2c1ccnc2Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties