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2-Bromoacetamide

CAT: 0013-GTR19188851-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19188851-02Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
2-Bromoacetamide is an emerging, unregulated disinfection by-product studied for its developmental toxicity in animal models. It acts as an alcohol dehydrogenase inhibitor, making it a relevant tool for in vitro enzyme studies and toxicological research on water treatment by-products.
CAS Number
683-57-8
Product Name Alternative
2 Bromoacetamide, 2Bromoacetamide, 2-Bromoacetamide, α-Bromoacetamide
Field of Research
Metabolism Research
Purity
99.83% (May vary between batches)
Solubility
DMSO:80 mg/mL (579.88 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (23.92 mM)
Smiles
O=C (N) CBr
Molecular Formula
C2H4BrNO
Molecular Weight
137.96
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Bromoacetamide
CAS Number683-57-8
PubChem CID69632
IUPAC Name2-bromoacetamide
Molecular FormulaC2H4BrNO
Molecular Weight137.96
XLogP-0.5
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity44
SMILES
C(C(=O)N)Br
InChI
InChI=1S/C2H4BrNO/c3-1-2(4)5/h1H2,(H2,4,5)
InChIKey
JUIKUQOUMZUFQT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromoacetamide
CAS: 683-57-8
CID: 69632
Formula: C2H4BrNO
MW: 137.96
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight137.96
XLogP3-0.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass136.94763
Monoisotopic Mass136.94763
Topological Polar Surface Area43.1 Ų
Heavy Atom Count5
Formal Charge0
Complexity44.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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