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Ethyl 2-bromobenzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
227.978591628
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₉BrO₂
0 references
canonical SMILES
CCOC(=O)C1=CC=CC=C1Br
0 references
Identifiers
InChI
InChI=1S/C9H9BrO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3
0 references
InChIKey
BIHHBTVQFPVSTE-UHFFFAOYSA-N
0 references
CAS Registry Number
6091-64-1
1 reference
InChIKey
BIHHBTVQFPVSTE-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=6091-64-1
PubChem CID
80186
1 reference
matched by identifier from
InChIKey
InChIKey
BIHHBTVQFPVSTE-UHFFFAOYSA-N
UniChem compound ID
8389792
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80209751
1 reference
matched by identifier from
InChIKey
InChIKey
BIHHBTVQFPVSTE-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30132242
0 references
NSC number
10122
0 references
EC number
228-034-3
0 references
ECHA Substance Infocard ID
100.025.486
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.025.486
retrieved
29 December 2019
title
Ethyl 2-bromobenzoate
(English)
quotation
CAS no.: 6091-64-1
(English)
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