Allyl chloroacetate
Product Information
Molecular Formula
C5H7ClO2
Molecular Weight
134.56
Description
Allyl chloroacetate (CAS# 2916-14-5 ) is a useful research chemical.
Synonyms
Acetic acid, chloro-, 2-propenyl ester; Acetic acid, chloro-, allyl ester; ALLYL CHLOROACETATE; ALLYL-(CHLORACETAT); CHLOROACETIC ACID ALLYL ESTER; Allyl chloroacetate, 98 %; Prop-2-enyl 2-chloroacetate; Chloroacetic acid 2-propenyl ester
IUPAC Name
prop-2-enyl 2-chloroacetate
SMILES
C=CCOC(=O)CCl
InChI
InChI=1S/C5H7ClO2/c1-2-3-8-5(7)4-6/h2H,1,3-4H2
InChI Key
VMBJJCDVORDOCF-UHFFFAOYSA-N
Boiling Point
164 °C (265 mmHg)
Flash Point
61 °C
Purity
98 %
Density
1.159 g/cm3
Appearance
Colorless liquid
Storage
Keep away from sources of ignition. Store in a cool, dry place. Store in a tightly closed container.
Refractive Index
n20/D 1.446 (lit.)
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Signal Word
Warning
Computed Properties
XLogP3
1.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
134.0134572 g/mol
Monoisotopic Mass
134.0134572 g/mol
Topological Polar Surface Area
26.3Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
90.4
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113912794-A | Itaconate bio-based elastomer with controllable sequence structure and adjustable cross-linking point distribution and preparation method thereof | 2021-09-23 |
| CN-113785839-A | Nematicidal compositions containing fluoroalkene sulfones and organophosphorus | 2021-09-17 |
| CN-112552597-A | Preparation method of antibacterial plastic for battery case production | 2020-12-11 |
| CN-112216427-A | Aluminum alloy conductor crosslinked polyethylene insulation power cable | 2020-10-13 |
| CN-112048173-A | Environment-friendly flame-retardant insulating material and preparation method thereof | 2020-09-14 |
| CN-111961285-A | Modified polypropylene kuppe for van | 2020-08-26 |
| KR-20220017125-A | Acrylic rubber composition, and acrylic rubber crosslinked product, acrylic rubber | 2020-08-04 |
| CN-111944341-A | Household environment-friendly coating and preparation method thereof | 2020-07-25 |
| CN-111607317-A | Flame-retardant and water-resistant ultraviolet-curing adhesive and preparation method thereof | 2020-05-19 |
| CN-111607317-B | Flame-retardant and water-resistant ultraviolet-curing adhesive and preparation method thereof | 2020-05-19 |
