Benzoic acid, 4,4'-(1,2-ethenediyl)bis-


Chemical Name: Benzoic acid, 4,4'-(1,2-ethenediyl)bis-
CAS Number: 100-31-2
Product Number: AG00006L(AGN-PC-01ZA5P)
Synonyms:
MDL No:
Molecular Formula: C16H12O4
Molecular Weight: 268.2641

Identification/Properties


Computed Properties
Molecular Weight:
268.268g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
268.074g/mol
Monoisotopic Mass:
268.074g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
336
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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