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158141-43-6 | 2-(5-ethyl-1,2-oxazol-3-yl)acetonitrile
CAS No: 158141-43-6 Catalog No: AG01DT4K MDL No:MFCD28550008
Product Description
Catalog Number:
AG01DT4K
Chemical Name:
2-(5-ethyl-1,2-oxazol-3-yl)acetonitrile
CAS Number:
158141-43-6
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
MDL Number:
MFCD28550008
IUPAC Name:
2-(5-ethyl-1,2-oxazol-3-yl)acetonitrile
InChI:
InChI=1S/C7H8N2O/c1-2-7-5-6(3-4-8)9-10-7/h5H,2-3H2,1H3
InChI Key:
ZKFPWDBPZCUNNC-UHFFFAOYSA-N
SMILES:
CCc1cc(no1)CC#N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.154g/mol
Monoisotopic Mass:
136.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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