methyl (2R)-2-bromopropanoate
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Basic information
- CAS
20047-41-0- Standard SMILES
COC(=O)[C@@H](C)Br- InChIKey
ACEONLNNWKIPTM-GSVOUGTGSA-N- Molecular formula
- C4H7BrO2
- Average molar mass
- 167 g/mol
- Monoisotopic mass
- 165.96294
Names & identifiers
- Preferred name
- methyl (2R)-2-bromopropanoate
- IUPAC
- methyl (2R)-2-bromopropanoate
- English name
- [R,(+)]-2-Bromopropanoic acid methyl ester
- Molecular formula
- C4H7BrO2
- Molecular weight
- 167
Names & synonyms
20047-41-0methyl (2R)-2-bromopropanoateRefChem:812058828-944-6(R)-Methyl 2-bromopropanoatePropanoic acid, 2-bromo-, methyl ester, (2R)-METHYL (R)-2-BROMOPROPANOATE[R,(+)]-2-Bromopropanoic acid methyl ester(R)-(+)-2-Bromopropanic acid methyl esterMFCD20486728Methyl (+)-2-bromopropionate[R,(+)]-2-Bromopropionic acid methyl ester
Show more names
Procaterol Impurity 24
Propanoic acid, 2-bromo-, methyl ester, (R)-Methyl 2(R)-bromopropionatemethyl (r)-2-bromopropionate5MZV88JD52SCHEMBL2322217Methyl (2R)-2-bromopropionate(R)-Methyl alpha-bromopropionateAT21844
Database identifiers
- CAS
20047-41-0- PubChem CID
- 1715216
- UNII
- 5MZV88JD52
- EC Number
- 828-944-6
- Nikkaji
- J56.913E
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 72.1
Physicochemical properties
- Boiling point
- 145.9 · 145.9±8.0 °C(Predicted)
- Density
- 1.496 · 1.496±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H314-H226
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
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
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07,GHS05
- Hazard statements
- H335-H314-H226
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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