2-Iodobenzylzinc bromide solution

CAT: 0024-sc-225429Size: 50 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-225429Size:50 mL

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CAS Number

117269-71-3

Chemical Information

2-Iodobenzylzinc bromide

CAS Number	117269-71-3
PubChem CID	14224094
IUPAC Name	bromozinc(1+);1-iodo-2-methanidylbenzene
Molecular Formula	C7H6BrIZn
Molecular Weight	362.3
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	80

SMILES

[CH2-]C1=CC=CC=C1I.[Zn+]Br

InChI

InChI=1S/C7H6I.BrH.Zn/c1-6-4-2-3-5-7(6)8;;/h2-5H,1H2;1H;/q-1;;+2/p-1

InChIKey

ZTCPHMNGJRYJGT-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 117269-71-3

CID: 14224094

Formula: C7H6BrIZn

MW: 362.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	362.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	359.79890
Monoisotopic Mass	359.79890
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	80
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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