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108745-29-5 | Imidazo[2,1-b][1,3]oxazepine(9CI)
CAS No: 108745-29-5 Catalog No: AG00839R MDL No:
Product Description
Catalog Number:
AG00839R
Chemical Name:
Imidazo[2,1-b][1,3]oxazepine(9CI)
CAS Number:
108745-29-5
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
IUPAC Name:
imidazo[2,1-b][1,3]oxazepine
InChI:
InChI=1S/C7H6N2O/c1-2-6-10-7-8-3-5-9(7)4-1/h1-6H
InChI Key:
ZGYZLNIMJPFPDV-UHFFFAOYSA-N
SMILES:
C1=COc2n(C=C1)ccn2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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