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(2R)-3-Bromo-2-hydroxy-2-methylpropionic Acid

CAT: 0572-TRC-B683755-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B683755-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
261904-39-6
Synonyms
(+)-(2R)-3-Bromo-2-hydroxy-2-methylpropanoic Acid; (2R)-3-Bromo-2-hydroxy-2-methylpropanoic Acid
Hazard Statement
No Data Available
Smiles
C[C@@](O)(CBr)C(=O)O
Molecular Formula
C4H7BrO3
Molecular Weight
183
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

(2R)-3-bromo-2-hydroxy-2-methylpropanoic acid
CAS Number261904-39-6
PubChem CID10582468
IUPAC Name(2R)-3-bromo-2-hydroxy-2-methylpropanoic acid
Molecular FormulaC4H7BrO3
Molecular Weight183.00
XLogP0.1
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity103
SMILES
C[C@](CBr)(C(=O)O)O
InChI
InChI=1S/C4H7BrO3/c1-4(8,2-5)3(6)7/h8H,2H2,1H3,(H,6,7)/t4-/m0/s1
InChIKey
HBJAYXGUOOININ-BYPYZUCNSA-N
Chemical Structure
2D Structure
2D structure of (2R)-3-bromo-2-hydroxy-2-methylpropanoic acid
CAS: 261904-39-6
CID: 10582468
Formula: C4H7BrO3
MW: 183.00
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight183.00
XLogP30.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass181.95786
Monoisotopic Mass181.95786
Topological Polar Surface Area57.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity103
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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