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110520-17-7 | Phenanthro[9,10-g]isoquinoline(9CI)
CAS No: 110520-17-7 Catalog No: AG007CR4 MDL No:
Product Description
Catalog Number:
AG007CR4
Chemical Name:
Phenanthro[9,10-g]isoquinoline(9CI)
CAS Number:
110520-17-7
Molecular Formula:
C21H13N
Molecular Weight:
279.3346
IUPAC Name:
phenanthro[9,10-g]isoquinoline
InChI:
InChI=1S/C21H13N/c1-3-7-18-16(5-1)17-6-2-4-8-19(17)21-12-15-13-22-10-9-14(15)11-20(18)21/h1-13H
InChI Key:
SOXFSTWNHNPRCA-UHFFFAOYSA-N
SMILES:
n1ccc2c(c1)cc1c(c2)c2ccccc2c2c1cccc2
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.342g/mol
Monoisotopic Mass:
279.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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