Methyl trans-4-bromo-2-butenoate
ALDRICH/16505 - technical, ≥90% (GC)
Synonym: Methyl 4-bromocrotonate
CAS Number: 6000-00-6
Empirical Formula (Hill Notation): C5H7BrO2
Molecular Weight: 179.01
MDL Number: MFCD00000246
Linear Formula: BrCH2CH=CHCOOCH3
Product Type: Chemical
assay | ≥90% (GC) |
bp | 70 °C/0.03 mmHg (lit.) |
contains | silver wool as stabilizer |
density | 1.498 g/mL at 20 °C (lit.) |
grade | technical |
impurities | ~3% methyl cis-4-bromo-2-butenoate |
InChI | 1S/C5H7BrO2/c1-8-5(7)3-2- |
InChI key | RWIKCBHOVNDESJ-NSCUHMNNSA |
refractive index | n |
SMILES string | COC(=O)C=CCBr |
storage temp. | 2-8°C |
Application: | Methyl trans-4-bromo-2-butenoate (Methyl 4-bromocrotonate) was used in the synthesis of highly substituted benzoxepines or benzopyrans and L-α-amino [4,5-3H]adipic acid. |
Packaging: | 5, 25 mL in glass bottle |
Symbol | GHS07 |
Signal word | Warning |
Hazard statements | H315 - H319 - H335 |
Precautionary statements | P302 + P352 - P305 + P351 + P338 |
Hazard Codes | Xi |
Risk Statements | 36/37/38 |
Safety Statements | 26 |
WGK Germany | WGK 3 |
Flash Point(F) | 197.6 °F |
Flash Point(C) | 92 °C |
Purity | ≥90% (GC) |
bp | 70 °C/0.03 mmHg (lit.) |
Density | 1.498 g/mL at 20 °C (lit.) |
Refractive Index | n |
Storage Temp. | 2-8°C |
UNSPSC | 12352100 |