Chloromethyl pivalate 98% supplier in China CAS NO.18997-19-8

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1. Introduction of Chloromethyl pivalate

The Chloromethyl pivalate, with its CAS NO 18997-19-8, is a kind of Colorless transparent liquid. It has synonyms of Pivalicacid, chloromethyl ester (8CI);Methanol, chloro-, pivalate (8CI);(2,2-Dimethyl-1-oxopropoxy)methyl chloride;2,2-Dimethylpropionic acidchloromethyl ester;Chloromethyl 2,2-dimethylpropanoate;[(tert-Butylcarbonyl)oxy]methyl chloride;a,a-Dimethylpropionyloxymethylchloride and Propanoicacid, 2,2-dimethyl-, chloromethyl ester.

2. Properties of Chloromethyl pivalate

Molecular Weight 150.60334 [g/mol]
Molecular Formula C6H11ClO2
XLogP3-AA 2.2
H-Bond Acceptor 2
Rotatable Bond Count 3
Exact Mass 150.044757
MonoIsotopic Mass 150.044757
Topological Polar Surface Area 26.3
Heavy Atom Count 9
Complexity 104 
Covalently-Bonded Unit Count 1
Feature 3D Acceptor Count 1
Feature 3D Hydrophobe Count 1
Effective Rotor Count 3
Conformer Sampling RMSD 0.6
CID Conformer Count 9

3. Structure descriptors of Chloromethyl pivalate

IUPAC Name: chloromethyl 2,2-dimethylpropanoate

InChI: InChI=1S/C6H11ClO2/c1-6(2,3)5(8)9-4-7/h4H2,1-3H3

InChIKey: GGRHYQCXXYLUTL-UHFFFAOYSA-N

Canonical SMILES : CC(C)(C)C(=O)OCCl

4. Application of Chloromethyl pivalate

Chloromethyl pivalate is used as medical or chemical intermediate product; it is the material for the products of third peroral cephalosporin antibiotic Cefetamet Pivoxil Hydrochloride ((6R，7R)-3-Methyl-7-((Z)-2-(2-Amino-group-4-Thiazole)-2-(amino-alpha-(methoxyimino) -Acetamido)-8-Aldo-5-Thia-1-Azabicyclc (4,2,0)Octyl-2-Alkene-2-methyl ester hydrochloride ) etc.