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(E) / (Z) -2,3-Dibromopropenoic Acid

CAT: 1299-RM-H010302-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H010302-01Size:10 mg
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CAS Number
24767-86-0
Synonyms
2,3-Dibromopropenoic acid (E) / (Z) ; (E) -2,3-dibromoacrylic acid compound with (Z) -2,3-dibromoacrylic acid
Molecular Formula
C3H2Br2O2
Molecular Weight
229.85
Target Alternative Name
Propanoic Acid
Product Name Synonym
2,3-Dibromopropenoic acid (E) / (Z) ; (E) -2,3-dibromoacrylic acid compound with (Z) -2,3-dibromoacrylic acid

Chemical Information

2,3-Dibromoacrylic acid
CAS Number24767-86-0
PubChem CID12998996
IUPAC Name(Z)-2,3-dibromoprop-2-enoic acid
Molecular FormulaC3H2Br2O2
Molecular Weight229.85
XLogP1.6
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count7
Formal Charge0
Complexity108
SMILES
C(=C(/C(=O)O)\Br)\Br
InChI
InChI=1S/C3H2Br2O2/c4-1-2(5)3(6)7/h1H,(H,6,7)/b2-1-
InChIKey
AZAFGYLHYXBSMI-UPHRSURJSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dibromoacrylic acid
CAS: 24767-86-0
CID: 12998996
Formula: C3H2Br2O2
MW: 229.85
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight229.85
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass229.84011
Monoisotopic Mass227.84215
Topological Polar Surface Area37.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity108
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes