Basic information
- CAS
631-28-7- Standard SMILES
CC(Br)(CBr)CBr- InChIKey
OIRQLILPXCJMIY-UHFFFAOYSA-N- Molecular formula
- C4H7Br3
- Average molar mass
- 294.81 g/mol
- Monoisotopic mass
- 291.80979
Names & identifiers
- Preferred name
- 1,2,3-Tribromo-2-methylpropane
- IUPAC
- 1,2,3-tribromo-2-methylpropane
- English name
- 1,2,3-tribromo-2-methylpropane
- Molecular formula
- C4H7Br3
- Molecular weight
- 294.81
Names & synonyms
1,2,3-Tribromo-2-methylpropane631-28-7Propane, 1,2,3-tribromo-2-methyl-X2KI49WEYMNSC-8997DTXSID40212428RefChem:71415DTXCID40134919211-152-4TBMPPropane, 2-methyl-1,2,3-tribromo-CCRIS 1641
Show more names
tribromomethylpropane
NSC 8997EINECS 211-152-4UNII-X2KI49WEYMBRN 1733867NSC89971,3-Tribromo-2-methylpropaneSCHEMBL8206649OIRQLILPXCJMIY-UHFFFAOYSA-N
Database identifiers
- CAS
631-28-7- PubChem CID
- 92137
- DTXSID
DTXSID40212428- UNII
- X2KI49WEYM
- EC Number
- 211-152-4
- Nikkaji
- J134.577J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 48.9
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -16.79 °C · -16.79°C (estimate)
- Boiling point
- 218.12 °C · 218.12°C (estimate)
- Density
- 2.2505 · 2.2505 (estimate)
- refractive index
- 1.5701 · 1.5701
- FDA UNII
- 2 KI49WEYM · X2KI49WEYM
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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