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89317-02-2 | Acetamide, N-(6-cyano-2,2-dimethyl-2H-1-benzopyran-4-yl)-
CAS No: 89317-02-2 Catalog No: AG003YIL MDL No:
Product Description
Catalog Number:
AG003YIL
Chemical Name:
Acetamide, N-(6-cyano-2,2-dimethyl-2H-1-benzopyran-4-yl)-
CAS Number:
89317-02-2
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
IUPAC Name:
N-(6-cyano-2,2-dimethylchromen-4-yl)acetamide
InChI:
InChI=1S/C14H14N2O2/c1-9(17)16-12-7-14(2,3)18-13-5-4-10(8-15)6-11(12)13/h4-7H,1-3H3,(H,16,17)
InChI Key:
ASLDLHGAODLNBR-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)C(=CC(O2)(C)C)NC(=O)C
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.278g/mol
Monoisotopic Mass:
242.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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