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89752-68-1 | 2,4-Hexadienamide, 4-bromo-N-2-pyridinyl-, (Z,E)-
CAS No: 89752-68-1 Catalog No: AG0040U8 MDL No:
Product Description
Catalog Number:
AG0040U8
Chemical Name:
2,4-Hexadienamide, 4-bromo-N-2-pyridinyl-, (Z,E)-
CAS Number:
89752-68-1
Molecular Formula:
C11H11BrN2O
Molecular Weight:
267.1218
IUPAC Name:
4-bromo-N-pyridin-2-ylhexa-2,4-dienamide
InChI:
InChI=1S/C11H11BrN2O/c1-2-9(12)6-7-11(15)14-10-5-3-4-8-13-10/h2-8H,1H3,(H,13,14,15)
InChI Key:
YBAMBTAPKSGFGG-UHFFFAOYSA-N
SMILES:
C/C=C(\C=C/C(=O)Nc1ccccn1)/Br
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.005g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.126g/mol
Monoisotopic Mass:
266.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.6
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