2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2-ethylhexyl ester


Chemical Name: 2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2-ethylhexyl ester
CAS Number: 6197-30-4
Product Number: AG00IAY6(AGN-PC-05W3YG)
Synonyms:
MDL No:
Molecular Formula: C24H27NO2
Molecular Weight: 361.4767

Identification/Properties


Properties
MP:
-10 °C
BP:
218°C at 1.5 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.567(lit.)
Computed Properties
Molecular Weight:
361.485g/mol
XLogP3:
7.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
10
Exact Mass:
361.204g/mol
Monoisotopic Mass:
361.204g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
510
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H413
Precautionary Statements:
P264-P270-P273-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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