2-Cyanoethylzinc bromide solution

CAT: 0024-sc-230237Size: 50 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-230237Size:50 mL

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CAS Number

312624-26-3

Chemical Information

2-Cyanoethylzinc bromide

CAS Number	312624-26-3
PubChem CID	4108069
IUPAC Name	bromozinc(1+);propanenitrile
Molecular Formula	C3H4BrNZn
Molecular Weight	199.4
Topological Polar Surface Area	23.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	6
Formal Charge	0
Complexity	46

SMILES

[CH2-]CC#N.[Zn+]Br

InChI

InChI=1S/C3H4N.BrH.Zn/c1-2-3-4;;/h1-2H2;1H;/q-1;;+2/p-1

InChIKey

CREYONULNRWHIX-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 312624-26-3

CID: 4108069

Formula: C3H4BrNZn

MW: 199.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	199.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	196.88185
Monoisotopic Mass	196.88185
Topological Polar Surface Area	23.8 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	46
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

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