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Chloromethyl pivalate

Chloromethyl pivalate structure

CAS No:
18997-19-8
Formula:
C6H11ClO2
Chemical Name:
Chloromethyl pivalate
Synonyms:
Propanoic acid,2,2-dimethyl-,chloromethyl ester;Pivalic acid,chloromethyl ester;Methanol,chloro-,pivalate;Chloromethyl 2,2-dimethylpropionate;Pivaloyloxymethyl chloride;Chloromethyl trimethylacetate;[(tert-Butylcarbonyl)oxy]methyl chloride;α,α-Dimethylpropionyloxymethyl chloride;Chloromethyl pivalate;Chloromethyl 2,2-dimethylpropanoate;(2,2-Dimethyl-1-oxopropoxy)methyl chloride;2,2-Dimethylpropionic acid chloromethyl ester;POM-Cl
Categories:
Chemical Reagents > Organic Reagents

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Chloromethyl pivalate Basic Attributes

Molecular Weight：

150.60300

Exact Mass：

150.60

EC Number：

242-735-1

UNII：

ZQU16YZ6MF

DSSTox ID：

DTXSID1066445

HScode：

2915600000

Characteristics

PSA：

26.30000

XLogP3：

2.2

Appearance：

clear colorless to very faint yellow clear liquid

Density：

1.045

Melting Point：

132-135 °C

Boiling Point：

70-72ºC (50 torr)

Flash Point：

40ºC

Refractive Index：

1.416-1.418

Storage Conditions：

Flammables area

Vapor Pressure：

5.45mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3272 3/PG 3

wgk germany：

hazard class code：

R10; R36/37/38

safety instructions：

S16-S36/37/39-S41

Marks：

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H226-H302 + H312 + H332-H315-H319-H335

GHS Classification：

|Danger|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 51 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Chloromethyl pivalate Use and Manufacturing

Uses

Chloromethyl Pivalate is used in the synthesis of oxazolines used in the preparation of imidazolium triflates. Also used in the synthesis of Src Kinase inhibitors used as anti-tumor agents.

Manufacturing Info：

Propanoic acid, 2,2-dimethyl-, chloromethyl ester: ACTIVE

Computed Properties

Molecular Weight:150.60
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:150.0447573
Monoisotopic Mass:150.0447573
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Paraformaldehyde

Formaldehyde

Zinc chloride

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