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55724-33-9 | 1-(2,2-Dimethylpropyl)isoquinoline
CAS No: 55724-33-9 Catalog No: AG00DV3N MDL No:
Product Description
Catalog Number:
AG00DV3N
Chemical Name:
1-(2,2-Dimethylpropyl)isoquinoline
CAS Number:
55724-33-9
IUPAC Name:
1-(2,2-dimethylpropyl)isoquinoline
InChI:
InChI=1S/C14H17N/c1-14(2,3)10-13-12-7-5-4-6-11(12)8-9-15-13/h4-9H,10H2,1-3H3
InChI Key:
OPFFYDNTKKPJMI-UHFFFAOYSA-N
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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