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1,2,3,4-Tetrabromobenzene

HCID 31137
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Basic information

CAS
22311-25-7
Standard SMILES
Brc1ccc(Br)c(Br)c1Br
InChIKey
QRFALSDGOMLVIR-UHFFFAOYSA-N
Molecular formula
C6H2Br4
Average molar mass
393.7 g/mol
Monoisotopic mass
389.689

Names & identifiers

Preferred name
1,2,3,4-Tetrabromobenzene
IUPAC
1,2,3,4-tetrabromobenzene
English name
Benzene,1,2,3,4-tetrabromo-
Molecular formula
C6H2Br4
Molecular weight
393.7

Names & synonyms

1,2,3,4-TETRABROMOBENZENEBenzene, 1,2,3,4-tetrabromo-UNII-LV347866P3LV347866P3DTXSID8074021RefChem:196665DTXCID703666222311-25-7MFCD18399967tetrabromobenzeneSCHEMBL149175SCHEMBL358557
Show more names
Benzene,1,2,3,4-tetrabromo-
SCHEMBL4375071SCHEMBL29646281SY272435Q27283198

Database identifiers

CAS
22311-25-7
PubChem CID
31137
DTXSID
DTXSID8074021
UNII
LV347866P3
Nikkaji
J1.610.293H

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
102

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP5.0

Physicochemical properties

FDA UNII
347866 P3 · LV347866P3
EPA Substance Registry System
1 · Benzene, 1,2,3,4-tetrabromo- (22311-25-7)

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