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1216202-07-1 | Isoquinoline, 1-chloro-5,7-dimethoxy-
CAS No: 1216202-07-1 Catalog No: AG0015F2 MDL No:
Product Description
Catalog Number:
AG0015F2
Chemical Name:
Isoquinoline, 1-chloro-5,7-dimethoxy-
CAS Number:
1216202-07-1
Molecular Formula:
C11H10ClNO2
Molecular Weight:
223.6556
IUPAC Name:
1-chloro-5,7-dimethoxyisoquinoline
InChI:
InChI=1S/C11H10ClNO2/c1-14-7-5-9-8(10(6-7)15-2)3-4-13-11(9)12/h3-6H,1-2H3
InChI Key:
YBGITNZIHLQWBX-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc2c1ccnc2Cl
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.656g/mol
Monoisotopic Mass:
223.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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