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7661-37-2 | 1-Propylisoquinoline
CAS No: 7661-37-2 Catalog No: AG00GFN4 MDL No:
Product Description
Catalog Number:
AG00GFN4
Chemical Name:
1-Propylisoquinoline
CAS Number:
7661-37-2
IUPAC Name:
1-propylisoquinoline
InChI:
InChI=1S/C12H13N/c1-2-5-12-11-7-4-3-6-10(11)8-9-13-12/h3-4,6-9H,2,5H2,1H3
InChI Key:
WGBFAILGFRYCLA-UHFFFAOYSA-N
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.243g/mol
Monoisotopic Mass:
171.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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