2-Butenamide, 2-cyano-N-(2,5-dibromophenyl)-3-hydroxy-


Chemical Name: 2-Butenamide, 2-cyano-N-(2,5-dibromophenyl)-3-hydroxy-
CAS Number: 62004-35-7
Product Number: AG00EB3N(AGN-PC-0AAFAY)
Synonyms:
MDL No: MFCD09878279
Molecular Formula: C11H8Br2N2O2
Molecular Weight: 360.0014

Identification/Properties


Properties
BP:
487.9°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
360.005g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
359.893g/mol
Monoisotopic Mass:
357.895g/mol
Topological Polar Surface Area:
73.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
386
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332-H315-H319
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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