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25003-82-1 | Naphth[1,2-g]isoquinoline (7CI,8CI,9CI)
CAS No: 25003-82-1 Catalog No: AG002Q60 MDL No:
Product Description
Catalog Number:
AG002Q60
Chemical Name:
Naphth[1,2-g]isoquinoline (7CI,8CI,9CI)
CAS Number:
25003-82-1
Molecular Formula:
C17H11N
Molecular Weight:
229.2759
IUPAC Name:
naphtho[1,2-g]isoquinoline
InChI:
InChI=1S/C17H11N/c1-2-4-16-12(3-1)5-6-14-9-15-11-18-8-7-13(15)10-17(14)16/h1-11H
InChI Key:
BIHVYFFSKHTVIG-UHFFFAOYSA-N
SMILES:
n1ccc2c(c1)cc1c(c2)c2ccccc2cc1
UNII:
AFX8IM3ER6
NSC Number:
117034
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.089g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.282g/mol
Monoisotopic Mass:
229.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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