Butanedioic acid, bromo-


Chemical Name: Butanedioic acid, bromo-
CAS Number: 923-06-8
Product Number: AG003OKS(AGN-PC-0JLB3F)
Synonyms:
MDL No:
Molecular Formula: C4H5BrO4
Molecular Weight: 196.9841

Identification/Properties


Properties
MP:
161-163 °C(lit.)
BP:
255℃
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4620 (estimate)
Solubility:
Insoluble in ether.
Computed Properties
Molecular Weight:
196.984g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
195.937g/mol
Monoisotopic Mass:
195.937g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
133
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:
H315-H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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