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245-51-2 | 10H-[1,4]Oxazino[4,3-a]benzimidazole
CAS No: 245-51-2 Catalog No: AG002OC6 MDL No:
Product Description
Catalog Number:
AG002OC6
Chemical Name:
10H-[1,4]Oxazino[4,3-a]benzimidazole
CAS Number:
245-51-2
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
IUPAC Name:
10H-[1,4]oxazino[4,3-a]benzimidazole
InChI:
InChI=1S/C10H8N2O/c1-2-4-9-8(3-1)11-10-7-13-6-5-12(9)10/h1-7,11H
InChI Key:
CDWOLSYDHITLKJ-UHFFFAOYSA-N
SMILES:
o1ccn2c(c1)[nH]c1c2cccc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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