2,2,3-Tribromobutane
Basic information
- CAS
62127-47-3- Standard SMILES
CC(Br)C(C)(Br)Br- InChIKey
JDWNTZIECWWBAO-UHFFFAOYSA-N- Molecular formula
- C4H7Br3
- Average molar mass
- 294.81 g/mol
- Monoisotopic mass
- 291.80978652
Names & identifiers
- Preferred name
- 2,2,3-Tribromobutane
- IUPAC
- 2,2,3-tribromobutane
- English name
- 2,2,3-Tribromobutane
- Molecular formula
- C4H7Br3
- Molecular weight
- 294.81
Names & synonyms
2,2,3-Tribromobutane62127-47-3Butane, 2,2,3-tribromo-EINECS 263-424-7DTXSID70871446RefChem:80838DTXCID00819114263-424-7JDWNTZIECWWBAO-UHFFFAOYSA-NMFCD000391722,2,3-Tribrom-butanC4H7Br3
Show more names
tribromobutane2,2,3-tribromo-butanInchi=1/C4H7br3/C1-3(5)4(2,6)7/H3H,1-2h
SCHEMBL11582285SCHEMBL27715734AKOS025295551SY054833DB-054069NS00056272
Database identifiers
- CAS
62127-47-3- PubChem CID
- 112468
- DTXSID
DTXSID70871446- EC Number
- 263-424-7
- Nikkaji
- J306.991E
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 60
Physicochemical properties
- Melting point
- 1.85 °C · 1.85°C
- Boiling point
- 86 °C · 86 °C / 14mmHg
- Density
- 2.18 · 2.18
- refractive index
- 1.561 to · 1.5610 to 1.5640
- Flash point
- 110 °C · 110 °C
- form
- clear liquid
- color
- Light yellow to Yellow to Orange
- EPA Substance Registry System
- 2 · Butane, 2,2,3-tribromo- (62127-47-3)
- TSCA
- TSCA listed
- HS Code
- 2903.39 · 2903.39.1550
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- hs_code
- 2903.39.1550
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationButane, 2,2,3-tribromo-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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