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922170-73-8 | 2-Butenamide, N-(2-iodo-4,6-dimethylphenyl)-N,2-dimethyl-, (2E)-
CAS No: 922170-73-8 Catalog No: AG006F9R MDL No:
Product Description
Catalog Number:
AG006F9R
Chemical Name:
2-Butenamide, N-(2-iodo-4,6-dimethylphenyl)-N,2-dimethyl-, (2E)-
CAS Number:
922170-73-8
Molecular Formula:
C14H18INO
Molecular Weight:
343.2033
IUPAC Name:
N-(2-iodo-4,6-dimethylphenyl)-N,2-dimethylbut-2-enamide
InChI:
InChI=1S/C14H18INO/c1-6-10(3)14(17)16(5)13-11(4)7-9(2)8-12(13)15/h6-8H,1-5H3
InChI Key:
DEPGUCWAFNPFCC-UHFFFAOYSA-N
SMILES:
C/C=C(/C(=O)N(c1c(C)cc(cc1I)C)C)\C
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.043g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.208g/mol
Monoisotopic Mass:
343.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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