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±, ±, ±', ±'-Tetrabromo-p-xylene

CAT: 0926-BAA59231Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-BAA59231Size:5 g
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CAS Number
1592-31-0
MDL Number
MFCD00017857
Smiles
C1=CC (=CC=C1C (Br) Br) C (Br) Br
Molecular Formula
C8H6Br4
Molecular Weight
421.75 g/mol
Controlled
No

Chemical Information

Benzene, 1,4-bis(dibromomethyl)-
CAS Number1592-31-0
PubChem CID74127
IUPAC Name1,4-bis(dibromomethyl)benzene
Molecular FormulaC8H6Br4
Molecular Weight421.75
XLogP4.8
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity111
SMILES
C1=CC(=CC=C1C(Br)Br)C(Br)Br
InChI
InChI=1S/C8H6Br4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4,7-8H
InChIKey
VIQBABDKNOOCQD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, 1,4-bis(dibromomethyl)-
CAS: 1592-31-0
CID: 74127
Formula: C8H6Br4
MW: 421.75
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight421.75
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass421.71620
Monoisotopic Mass417.72030
Topological Polar Surface Area0 Ų
Heavy Atom Count12
Formal Charge0
Complexity111
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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Alternative Products

CatalogName
sc-476107α, α, α', α'-Tetrabromo-p-xylene
T02150-01A, a, a', a'-Tetrabromo-p-xylene
sc-233793α, α, α', α'-Tetrabromo-m-xylene
OR1025118-01α, α, α′, α′-Tetrabromo-O-Xylene
289738-01A, a, a', a'-Tetrabromo-O-xylene
sc-254932α, α, α', α'-Tetrabromo-o-xylene
sc-2308932,3,5,6-Tetrabromo-p-xylene
T02140A, a, a', a'-Tetrabromo-m-xylene 95%
T02135-01A, a, a', a'-Tetrabromo-o-xylene 97%
419998-012,3,5,6-Tetrabromo-p-xylene-d6

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