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6502-59-6 | 1H-Pyrrolo[2,3-f]isoquinoline
CAS No: 6502-59-6 Catalog No: AG00H6B5 MDL No:MFCD13178647
Product Description
Catalog Number:
AG00H6B5
Chemical Name:
1H-Pyrrolo[2,3-f]isoquinoline
CAS Number:
6502-59-6
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
MDL Number:
MFCD13178647
IUPAC Name:
1H-pyrrolo[2,3-f]isoquinoline
InChI:
InChI=1S/C11H8N2/c1-2-9-7-12-5-4-10(9)11-8(1)3-6-13-11/h1-7,13H
InChI Key:
GTWRYPDLQCRRQK-UHFFFAOYSA-N
SMILES:
c1ncc2c(c1)c1[nH]ccc1cc2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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