4-Bromobenzylzinc bromide solution

CAT: 0024-sc-226547Size: 50 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-226547Size:50 mL

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CAS Number

115055-85-1

Chemical Information

4-Bromobenzylzinc bromide

CAS Number	115055-85-1
PubChem CID	5061994
IUPAC Name	1-bromo-4-methanidylbenzene;bromozinc(1+)
Molecular Formula	C7H6Br2Zn
Molecular Weight	315.3
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	70

SMILES

[CH2-]C1=CC=C(C=C1)Br.[Zn+]Br

InChI

InChI=1S/C7H6Br.BrH.Zn/c1-6-2-4-7(8)5-3-6;;/h2-5H,1H2;1H;/q-1;;+2/p-1

InChIKey

HJQDBIKHGQSYJU-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 115055-85-1

CID: 5061994

Formula: C7H6Br2Zn

MW: 315.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	315.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	313.81072
Monoisotopic Mass	311.81277
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	70
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-230071	2-Bromobenzylzinc bromide solution
sc-299428	4-Bromobenzylzinc chloride solution
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sc-311038	4-Iodobenzylzinc bromide solution
sc-226772	4-Phenoxyphenylmagnesium bromide solution
sc-226592	4-Chlorobutylzinc bromide solution
sc-226497	4-Benzyloxyphenylmagnesium bromide solution
sc-232943	4-Pentenylzinc bromide solution
sc-226798	4-Thioanisolemagnesium bromide solution
sc-226613	4-Cyanobenzylzinc bromide solution

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