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bromomaleic acid

CAS No.:
584-99-6
Catalog Number:
AG00EQX1
Molecular Formula:
C4H3BrO4
Molecular Weight:
194.9682
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Product Description
Catalog Number:
AG00EQX1
Chemical Name:
bromomaleic acid
CAS Number:
584-99-6
Molecular Formula:
C4H3BrO4
Molecular Weight:
194.9682
MDL Number:
MFCD26407756
IUPAC Name:
(E)-2-bromobut-2-enedioic acid
InChI:
InChI=1S/C4H3BrO4/c5-2(4(8)9)1-3(6)7/h1H,(H,6,7)(H,8,9)/b2-1+
InChI Key:
SOWPGKJPEXNMCS-OWOJBTEDSA-N
SMILES:
OC(=O)C=C(C(=O)O)Br
NSC Number:
227869
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
193.921g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.968g/mol
Monoisotopic Mass:
193.921g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties