3,4,5-Tribromotoluene
Basic information
- CAS
73557-59-2- Standard SMILES
Cc1cc(Br)c(Br)c(Br)c1- InChIKey
WXXWZBRTZPAFSP-UHFFFAOYSA-N- Molecular formula
- C7H5Br3
- Average molar mass
- 328.83 g/mol
- Monoisotopic mass
- 325.79414
Names & identifiers
- Preferred name
- 3,4,5-Tribromotoluene
- IUPAC
- 1,2,3-tribromo-5-methylbenzene
- English name
- 3,4,5-Tribromotoluene
- Molecular weight
- 0
Names & synonyms
3,4,5-Tribromotoluene73557-59-21,2,3-Tribromo-5-methylbenzeneBenzene,1,2,3-tribromo-5-methyl-starbld00258093,4,5-Tribrom-toluolSCHEMBL1966924SCHEMBL4060849SCHEMBL8723718SCHEMBL8782146DTXSID502750841,2,3-tribromo-5-methyl-benzene
Show more names
1,2,3-Tribromo-5-methylbenzene #MFCD00075798FT66991AS-81859DB-390185E83905F852108
Database identifiers
- CAS
73557-59-2- PubChem CID
- 33914
- DTXSID
DTXSID50275084
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- solubility
- Chloroform (Sparingly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- White to Off-White
- InChI
- InChI=1S/C7H5Br3/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,1H3
- InChIKey
- WXXWZBRTZPAFSP-UHFFFAOYSA-N
- SMILES
- C1(C)=CC(Br)=C(Br)C(Br)=C1
Chemistry & industry
Upstream & downstream products
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Compound notes
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