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55613-13-3

55613-13-3 | 2-Phenyl-oxazole-4-carbonitrile

CAS No: 55613-13-3 Catalog No: AG00DLY2 MDL No:

Product Description

Catalog Number:
AG00DLY2
Chemical Name:
2-Phenyl-oxazole-4-carbonitrile
CAS Number:
55613-13-3
IUPAC Name:
2-amino-1,3-oxazole-4-carbonitrile
InChI:
InChI=1S/C4H3N3O/c5-1-3-2-8-4(6)7-3/h2H,(H2,6,7)
InChI Key:
SQXSAKSTBAYJJW-UHFFFAOYSA-N

Properties

Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.028g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
109.088g/mol
Monoisotopic Mass:
109.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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