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162701-90-8 | Acetamide, N-(4-cyano-3-methyl-5-isoxazolyl)- (9CI)
CAS No: 162701-90-8 Catalog No: AG00ATOF MDL No:
Product Description
Catalog Number:
AG00ATOF
Chemical Name:
Acetamide, N-(4-cyano-3-methyl-5-isoxazolyl)- (9CI)
CAS Number:
162701-90-8
IUPAC Name:
N-(4-cyano-3-methyl-1,2-oxazol-5-yl)acetamide
InChI:
InChI=1S/C7H7N3O2/c1-4-6(3-8)7(12-10-4)9-5(2)11/h1-2H3,(H,9,11)
InChI Key:
XNLFWQIUOGAYCP-UHFFFAOYSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.152g/mol
Monoisotopic Mass:
165.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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