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Home > Indoles and Oxindole > 160763-17-7
160763-17-7 | 2,5-Methano-2H-isoindole (9CI)
CAS No: 160763-17-7 Catalog No: AG001VB6 MDL No:
Product Description
Catalog Number:
AG001VB6
Chemical Name:
2,5-Methano-2H-isoindole (9CI)
CAS Number:
160763-17-7
Molecular Formula:
C9H7N
Molecular Weight:
129.1586
IUPAC Name:
1-azatricyclo[4.3.1.03,8]deca-2,4,6,8-tetraene
InChI:
InChI=1S/C9H7N/c1-2-8-5-10-4-7(1)3-9(8)6-10/h1-3,5-6H,4H2
InChI Key:
LVYZVPYNBNCEJP-UHFFFAOYSA-N
SMILES:
c1cc2cn3Cc1cc2c3
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.058g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.162g/mol
Monoisotopic Mass:
129.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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