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17491-89-3 | Cyclopropa[3,4]cyclopenta[1,2-c]pyridine (8CI,9CI)
CAS No: 17491-89-3 Catalog No: AG00202D MDL No:
Product Description
Catalog Number:
AG00202D
Chemical Name:
Cyclopropa[3,4]cyclopenta[1,2-c]pyridine (8CI,9CI)
CAS Number:
17491-89-3
Molecular Formula:
C9H5N
Molecular Weight:
127.1427
IUPAC Name:
8-azatricyclo[4.4.0.02,4]deca-1(6),2,4,7,9-pentaene
InChI:
InChI=1S/C9H5N/c1-2-10-5-7-3-6-4-9(6)8(1)7/h1-5H
InChI Key:
HKWBMDHMHPKBIA-UHFFFAOYSA-N
SMILES:
c1ncc2c(c1)c1cc1c2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.042g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.146g/mol
Monoisotopic Mass:
127.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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