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(R) -3,3,3-TRIFLUORO-2-HYDROXYPROPIONIC ACID

CAT: 1266-JH90233Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH90233Size:1 Each
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CAS Number
121250-04-2
UN Code
UN3466
Hazard Statement
Xn
Stability
Stable. Incompatible with strong acids, strong bases.
Molecular Formula
C3H3F3O3
Molecular Weight
144.05
Product Name Synonym
(METHYL BENZOATE) TRICARBONYLCHROMIUM
Physical Properties
Red to red-brown Powder
Hazardous Class
6.1
Safety Statements
S26-S37/39
Density
1.656g/cm3
Flash Point
108.9oC
RIDADR
UN3466
Melting Point
66-71oC

Chemical Information

(2R)-3,3,3-trifluoro-2-hydroxypropanoic acid
CAS Number121250-04-2
PubChem CID2779069
IUPAC Name(2R)-3,3,3-trifluoro-2-hydroxypropanoic acid
Molecular FormulaC3H3F3O3
Molecular Weight144.05
XLogP0.3
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity118
SMILES
[C@@H](C(=O)O)(C(F)(F)F)O
InChI
InChI=1S/C3H3F3O3/c4-3(5,6)1(7)2(8)9/h1,7H,(H,8,9)/t1-/m1/s1
InChIKey
BVKGUTLIPHZYCX-PVQJCKRUSA-N
Chemical Structure
2D Structure
2D structure of (2R)-3,3,3-trifluoro-2-hydroxypropanoic acid
CAS: 121250-04-2
CID: 2779069
Formula: C3H3F3O3
MW: 144.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight144.05
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass144.00342844
Monoisotopic Mass144.00342844
Topological Polar Surface Area57.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity118
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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