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80880-55-3 | 2,4-Hexadienamide, N,N-bis(1-methylethyl)-, (E,E)-
CAS No: 80880-55-3 Catalog No: AG005IAS MDL No:
Product Description
Catalog Number:
AG005IAS
Chemical Name:
2,4-Hexadienamide, N,N-bis(1-methylethyl)-, (E,E)-
CAS Number:
80880-55-3
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
IUPAC Name:
N,N-di(propan-2-yl)hexa-2,4-dienamide
InChI:
InChI=1S/C12H21NO/c1-6-7-8-9-12(14)13(10(2)3)11(4)5/h6-11H,1-5H3
InChI Key:
WMZDIDNJNLHYCE-UHFFFAOYSA-N
SMILES:
C/C=C/C=C/C(=O)N(C(C)C)C(C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.306g/mol
Monoisotopic Mass:
195.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.8
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