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42341-47-9 | 1H-IMIDAZO[1,2-A]AZEPINE
CAS No: 42341-47-9 Catalog No: AG0072PM MDL No:
Product Description
Catalog Number:
AG0072PM
Chemical Name:
1H-IMIDAZO[1,2-A]AZEPINE
CAS Number:
42341-47-9
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
IUPAC Name:
1H-imidazo[1,2-a]azepine
InChI:
InChI=1S/C8H8N2/c1-2-4-8-9-5-7-10(8)6-3-1/h1-7,9H
InChI Key:
TXOJGPGCRACVGL-UHFFFAOYSA-N
SMILES:
c1ccn2c(cc1)[nH]cc2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.069g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
132.166g/mol
Monoisotopic Mass:
132.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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