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88696-57-5 | Acetamide, 2-cyano-2-(tetrahydro-2H-pyran-2-ylidene)-
CAS No: 88696-57-5 Catalog No: AG0046LU MDL No:
Product Description
Catalog Number:
AG0046LU
Chemical Name:
Acetamide, 2-cyano-2-(tetrahydro-2H-pyran-2-ylidene)-
CAS Number:
88696-57-5
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
IUPAC Name:
2-cyano-2-(oxan-2-ylidene)acetamide
InChI:
InChI=1S/C8H10N2O2/c9-5-6(8(10)11)7-3-1-2-4-12-7/h1-4H2,(H2,10,11)
InChI Key:
BTKKQJHQZQWVDA-UHFFFAOYSA-N
SMILES:
N#CC(=C1CCCCO1)C(=O)N
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0
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