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385416-18-2 | 4-ETHYL-3-PHENYLISOQUINOLINE
CAS No: 385416-18-2 Catalog No: AG00C7MW MDL No:
Product Description
Catalog Number:
AG00C7MW
Chemical Name:
4-ETHYL-3-PHENYLISOQUINOLINE
CAS Number:
385416-18-2
IUPAC Name:
4-ethyl-3-phenylisoquinoline
InChI:
InChI=1S/C17H15N/c1-2-15-16-11-7-6-10-14(16)12-18-17(15)13-8-4-3-5-9-13/h3-12H,2H2,1H3
InChI Key:
GFEFQZJGUGZSIB-UHFFFAOYSA-N
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.314g/mol
Monoisotopic Mass:
233.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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