TERT-BUTYL CHLOROACETATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H11ClO2
Molecular Weight	150.603
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TERT-BUTYL CHLOROACETATE

Structure Search

SMILES

CC(C)(C)OC(=O)CCl

InChI

InChIKey=KUYMVWXKHQSIAS-UHFFFAOYSA-N

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

HIDE SMILES / InChI

Molecular Formula	C6H11ClO2
Molecular Weight	150.603
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Synthesis of imidazol-1-yl-acetic acid hydrochloride: a key intermediate for zoledronic acid.	2008	19104672

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:19:03 GMT 2025` Edited by `admin` on `Mon Mar 31 21:19:03 GMT 2025`
Record UNII	05TMW98298
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-87891

Preferred Name

English

TERT-BUTYL CHLOROACETATE

Systematic Name

English

TERT-BUTYL CHLOROACETATE [MI]

Common Name

English

CHLOROACETIC ACID TERT-BUTYL ESTER

Systematic Name

English

T-BUTYL CHLOROACETATE

Systematic Name

English

2-CHLOROACETIC ACID 1,1-DIMETHYLETHYL ESTER

Systematic Name

English

ACETIC ACID, CHLORO-, TERT-BUTYL ESTER

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

203-506-1

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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MERCK INDEX

m2834

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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Merck Index

CAS

107-59-5

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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NSC

87891

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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EPA CompTox

DTXSID7059351

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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FDA UNII

05TMW98298

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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PUBCHEM

66052

Created by admin on Mon Mar 31 21:19:03 GMT 2025 , Edited by admin on Mon Mar 31 21:19:03 GMT 2025

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