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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO4
Molecular Weight 195.1721
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 2-nitrobenzoate

SMILES

CCOC(=O)C1=CC=CC=C1[N+]([O-])=O

InChI

InChIKey=CPNMAYYYYSWTIV-UHFFFAOYSA-N
InChI=1S/C9H9NO4/c1-2-14-9(11)7-5-3-4-6-8(7)10(12)13/h3-6H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H9NO4
Molecular Weight 195.1721
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:23:36 GMT 2025
Edited
by admin
on Tue Apr 01 20:23:36 GMT 2025
Record UNII
NJJ25B6JXT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AI3-04245
Preferred Name English
Ethyl 2-nitrobenzoate
Systematic Name English
Benzoic acid, o-nitro-, ethyl ester
Systematic Name English
Ethyl o-nitrobenzoate
Systematic Name English
Benzoic acid, 2-nitro-, ethyl ester
Systematic Name English
NSC-4685
Code English
Code System Code Type Description
NSC
4685
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
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PUBCHEM
69123
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
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CAS
610-34-4
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
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FDA UNII
NJJ25B6JXT
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
PRIMARY
ECHA (EC/EINECS)
210-220-0
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
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EPA CompTox
DTXSID60209855
Created by admin on Tue Apr 01 20:23:36 GMT 2025 , Edited by admin on Tue Apr 01 20:23:36 GMT 2025
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