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| CAS No.: | 927-58-2 |
|---|---|
| Name: | 4-Bromobutyryl chloride |
| Molecular Structure: | |
|
|
|
| Formula: | C4H6BrClO |
| Molecular Weight: | 185.448 |
| Synonyms: | 4-Bromobutanoic acid chloride;4-Bromobutanoyl chloride;4-Bromobutyroylic chloride; |
| EINECS: | 213-154-0 |
| Density: | 1.595 g/cm3 |
| Boiling Point: | 192.7 °C at 760 mmHg |
| Flash Point: | 91.1 °C |
| Solubility: | Miscible with organic solvents. Immiscible with water. |
| Appearance: | clear colorless to slightly yellow |
| Hazard Symbols: |
 C
|
| Risk Codes: | 14-34-37 |
| Safety: | 26-36/37/39-45 |
| Transport Information: | 26-36/37/39-45 |
| PSA: | 17.07000 |
| LogP: | 1.92690 |
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Chemistry
Molecular Structure of 4-Bromobutyryl chloride (CAS NO.927-58-2):
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IUPAC Name: 4-bromobutanoyl chloride
Empirical Formula: C4H6BrClO
Molecular Weight: 185.4468
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 3
Polar Surface Area: 17.07 Å2
Index of Refraction: 1.482
Molar Refractivity: 33.19 cm3
Molar Volume: 116.2 cm3
Surface Tension: 37.1 dyne/cm
Density: 1.595 g/cm3
Flash Point: 91.1 °C
Enthalpy of Vaporization: 42.89 kJ/mol
Boiling Point: 192.7 °C at 760 mmHg
Vapour Pressure: 0.483 mmHg at 25°C
Storage temp: 2-8°C
Sensitive: Moisture Sensitive
BRN: 1743026
InChI
InChI=1/C4H6BrClO/c5-3-1-2-4(6)7/h1-3H2
Smiles
O=C(CCCBr)Cl
EINECS: 213-154-0
Product Categories: Acid HalidesPeptide Synthesis; Bifunctional Crosslinkers; Carbonyl Compounds; Linkers; Organic Building Blocks
Safety Profile
Hazard Codes: 
C
Risk Statements: 14-34-37
R14 :Reacts violently with water.
R34:Causes burns.
R37:Irritating to respiratory system
Safety Statements: 26-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 3265 8/PG 2
WGK Germany: 3
F: 3-8-10
HazardClass: 8
PackingGroup: II
Specification
4-Bromobutyryl chloride , with CAS number of 927-58-2, can be called 4-Bromobutanoic acid chloride ; 4-Bromobutanoyl chloride ; 4-Bromobutyroylic chloride .