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1,2,2,3-Tetrabromopropane

HCID 41044
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Basic information

CAS
54268-02-9
Standard SMILES
BrCC(Br)(Br)CBr
InChIKey
SNLFZAHVOKOBOP-UHFFFAOYSA-N
Molecular formula
C3H4Br4
Average molar mass
359.68 g/mol
Monoisotopic mass
355.70465

Names & identifiers

Preferred name
1,2,2,3-Tetrabromopropane
IUPAC
1,2,2,3-tetrabromopropane
English name
1,2,2,3-Tetrabromopropane
Molecular formula
C3H4Br4
Molecular weight
359.68

Names & synonyms

1,2,2,3-TETRABROMOPROPANE54268-02-9DTXSID60202624RefChem:1051863DTXCID90125115MFCD07780277Propane,1,2,2,3-tetrabromo-Propane, 1,2,2,3-tetrabromo-C3H4Br4SCHEMBL17558058

Database identifiers

CAS
54268-02-9
PubChem CID
41044
DTXSID
DTXSID60202624
Nikkaji
J570.718H

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
7
Formal charge
0
Complexity
44.9

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Melting point
10.7 °C · 10.7°C
Boiling point
245.82 °C · 245.82°C (rough estimate)
Density
2.7262 · 2.7262 (rough estimate)
refractive index
1.617 · 1.6170

Chemistry & industry

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NARCHEM[email protected]

Related reactions

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Compound notes

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