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630422-59-2 | 1-Chloro-6-isopropylisoquinoline
CAS No: 630422-59-2 Catalog No: AG01FLOT MDL No:
Product Description
Catalog Number:
AG01FLOT
Chemical Name:
1-Chloro-6-isopropylisoquinoline
CAS Number:
630422-59-2
IUPAC Name:
1-chloro-6-propan-2-ylisoquinoline
InChI:
InChI=1S/C12H12ClN/c1-8(2)9-3-4-11-10(7-9)5-6-14-12(11)13/h3-8H,1-2H3
InChI Key:
NZWSRHJSXZLLJC-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.066g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.685g/mol
Monoisotopic Mass:
205.066g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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