Sodium bromoacetate

CAT: 0024-sc-272479Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-272479Size:5 g

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CAS Number

1068-52-6

Chemical Information

Sodium bromoacetate

CAS Number	1068-52-6
PubChem CID	23675628
IUPAC Name	sodium 2-bromoacetate
Molecular Formula	C2H2BrNaO2
Molecular Weight	160.93
Topological Polar Surface Area	40.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	6
Formal Charge	0
Complexity	46

SMILES

C(C(=O)[O-])Br.[Na+]

InChI

InChI=1S/C2H3BrO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1

InChIKey

SESSOVUNEZQNBV-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 1068-52-6

CID: 23675628

Formula: C2H2BrNaO2

MW: 160.93

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	160.93
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	159.91359
Monoisotopic Mass	159.91359
Topological Polar Surface Area	40.1 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	46.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
sc-235416	Isopropyl bromoacetate
sc-250365	Methyl bromoacetate
sc-229603	Trimethylsilyl bromoacetate
sc-239316	Benzyl bromoacetate
sc-236358	Phenyl bromoacetate
sc-269888	N-Propyl bromoacetate
sc-212278	N-Succinimidyl Bromoacetate
sc-253634A	Tert-Butyl bromoacetate
sc-267702	4-Nitrophenyl bromoacetate
sc-236997	Tert-Butyldimethylsilyl bromoacetate

Catalog	Name
OR1014962-01	Sodium 2-Bromoacetate
FI57980-01	Isopropyl bromoacetate
275739-01	Ethyl bromoacetate
163215	Cumyl Bromoacetate
8MTT-Bromoacetate-1mg	8MTT-Bromoacetate
TRC-I780125-500MG	Isobutyl Bromoacetate
AAA62072	Phenyl Bromoacetate
455867-01	Methyl Bromoacetate
443653-01	Butyl Bromoacetate
OR1028591-01	Trimethylsilyl Bromoacetate