Propanedioic acid, (4-bromophenyl)-, dimethyl ester


Chemical Name: Propanedioic acid, (4-bromophenyl)-, dimethyl ester
CAS Number: 149506-35-4
Product Number: AG001LSH(AGN-PC-03F59L)
Synonyms:
MDL No:
Molecular Formula: C11H11BrO4
Molecular Weight: 287.1066

Identification/Properties


Computed Properties
Molecular Weight:
287.109g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
285.984g/mol
Monoisotopic Mass:
285.984g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
243
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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