(Q72473250)

English

Ethyl 2-bromoisobutyrate

chemical compound

Ethyl 2-bromo-2-methylpropionate
2-Bromoisobutyric acid ethyl ester
2-Bromo-2-methylpropionic acid ethyl ester

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

193.994241692 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₆H₁₁BrO₂

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canonical SMILES

CCOC(=O)C(C)(C)Br

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Identifiers

InChI

InChI=1S/C6H11BrO2/c1-4-9-5(8)6(2,3)7/h4H2,1-3H3

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InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

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CAS Registry Number

600-00-0

1 reference

InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=600-00-0

PubChem CID

11745

1 reference

matched by identifier from

InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

SureChEMBL ID

SCHEMBL36821

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

1 reference

NMRShiftDB structure ID

20181415

1 reference

matched by identifier from

InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

DSSTox substance ID

DTXSID4060523

1 reference

matched by identifier from

InChIKey

IOLQWGVDEFWYNP-UHFFFAOYSA-N

DSSTOX compound identifier

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209-980-6

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ECHA Substance Infocard ID

100.009.074

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.009.074

retrieved

29 December 2019

title

Ethyl 2-bromo-2-methylpropionate (English)

quotation

CAS no.: 600-00-0 (English)

(Q72473250)

Ethyl 2-bromoisobutyrate

Statements

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