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α-Chloropropionyl chloride;2-Chloropropionyl chloride (7623-09-8)

Identification
CAS:7623-09-8
EINECS: 231-540-7
Molecular Formula: C3H4Cl2O
Molecular Weight: 126.97
InChI: InChI=1/C3H4Cl2O/c1-2(4)3(5)6/h2H,1H3
Molecular Structure: (C3H4Cl2O) Propionylchloride, 2-chloro- (6CI,7CI,8CI);(?à)-2-Chloropropionyl chloride;2-Chloro-2-methylacetylc...
Properties
Transport:UN 2920
Density:1.308
Refractive index:1.439-1.441
Water Solubility:MAY DECOMPOSE
Solubility:MAY DECOMPOSE with water
Appearance:clear colorless to light yellow liquid
Specification:

The 2-Chloropropionyl chloride, with the cas registry number 7623-09-8, is a kind of clear colorless to light yellow liquid, with the product categories including Acid Halides; Carbonyl Compounds; Organic Building Blocks. Then it is a kind of chemical which is incompatible with strong oxidizing agents,strong bases, amines,alcohols. As to its usage, it could be used as the intermediate in the pharmaceutic, dyes, pesticide and also as the crops protective agent. What's more, it could be prepared by the 1,2-dichloropropane.

The physical properties of this chemical are below: (1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.04; (4)ACD/LogD (pH 7.4): 1.04; (5)ACD/BCF (pH 5.5): 3.61; (6)ACD/BCF (pH 7.4): 3.61; (7)ACD/KOC (pH 5.5): 87.32; (8)ACD/KOC (pH 7.4): 87.32; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07; (13)Index of Refraction: 1.434; (14)Molar Refractivity: 25.63 cm3; (15)Molar Volume: 98.3 cm3; (16)Polarizability: 10.16 ×10-24 cm3; (17)Surface Tension: 30.3 dyne/cm; (18)Density: 1.291 g/cm3; (19)Flash Point: 41.8 °C; (20)Enthalpy of Vaporization: 34.88 kJ/mol; (21)Boiling Point: 110.1 °C at 760 mmHg; (22)Vapour Pressure: 24.1 mmHg at 25°C; (23)Exact Mass: 125.96392; (24)MonoIsotopic Mass: 125.96392; (25)Topological Polar Surface Area: 17.1; (26)Heavy Atom Count: 6; (27)Formal Charge: 0; (28)Complexity: 61.8.

When you are using this chemical, you should be very cautious. For being a kind of corrosive chemical, it may destroy living tissue on contact. Then it is flammable which may causes severe burns. Besides, it is irritating to respiratory system.

Therefore, you should be better take the following advices to protect yourself. Wear suitable protective clothing, gloves and eye/face protection. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice, and if in case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). And you could keep away from sources of ignition - No smoking and then remember to avoid contacting with eyes.

Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CC(C(=O)Cl)Cl
(2)InChI: InChI=1S/C3H4Cl2O/c1-2(4)3(5)6/h2H,1H3
(3)InChIKey: JEQDSBVHLKBEIZ-UHFFFAOYSA-N 

Packinggroup: II
Storage Temperature: Flammables area
Safety Data
Hazard Symbols C:Corrosive