Butanoic acid, 2,4-dibromo-, ethyl ester
Basic information
- CAS
36847-51-5- Standard SMILES
CCOC(=O)C(Br)CCBr- InChIKey
VNXZZPZKCMJBME-UHFFFAOYSA-N- Molecular formula
- C6H10Br2O2
- Average molar mass
- 273.95 g/mol
- Monoisotopic mass
- 271.90475
Names & identifiers
- Preferred name
- Butanoic acid, 2,4-dibromo-, ethyl ester
- IUPAC
- ethyl 2,4-dibromobutanoate
- English name
- Ethyl 2,4-dibromobutyrate
- Molecular formula
- C6H10Br2O2
- Molecular weight
- 273.95
Names & synonyms
Ethyl 2,4-dibromobutanoate36847-51-5Butanoic acid, 2,4-dibromo-, ethyl esterEINECS 253-240-5NSC 60691DTXSID20885654Ethyl .alpha.,.gamma.-dibromobutyrateRefChem:122080Ethyl alpha,gamma-dibromobutyrateDTXCID601025019VNXZZPZKCMJBME-UHFFFAOYSA-NEthyl 2,4-dibromobutyrate
Show more names
Monostearin Impurity 52,4-dibromo-butanoicaciethylesterETHYL-ALPHA,GAMMA-DIBROMOBUTYRATE2,4-Dibromobutanoic acid ethyl ester4-(2-methylpropyl)-1,3-thiazol-2-amine1-[methyl(phenyl)phosphoryl]oxy-4-nitrobenzene
2,4-DIBROMO-BUTYRIC ACID ETHYL ESTERMFCD00039198Ethyl2,4-dibromobutanoateSCHEMBL698352NSC60691AB1432NSC-60691AKOS015843360
Database identifiers
- CAS
36847-51-5- PubChem CID
- 97950
- DTXSID
DTXSID20885654- EC Number
- 253-240-5
- Nikkaji
- J260.689E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 106
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 222.5 °C · 222.5°C (rough estimate)
- Density
- 1.6987 · 1.6987
- refractive index
- 1.496 · 1.4960 (estimate)
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- Colorless to light yellow Liquid
- CAS DataBase Reference
- 36847 · 36847-51-5(CAS DataBase Reference)
- EPA Substance Registry System
- 2 · Ethyl 2,4-dibromobutyrate (36847-51-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationButanoic acid, 2,4-dibromo-, ethyl ester: INACTIVE
Upstream & downstream products
Upstream raw materials
Related reactions
4 records
Compound notes
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