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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7NO5
Molecular Weight 197.1449
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methoxy-4-nitrobenzoic acid

SMILES

COC1=C(C=CC(=C1)C(O)=O)[N+]([O-])=O

InChI

InChIKey=PWURRRRGLCVBMX-UHFFFAOYSA-N
InChI=1S/C8H7NO5/c1-14-7-4-5(8(10)11)2-3-6(7)9(12)13/h2-4H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H7NO5
Molecular Weight 197.1449
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 Sat Dec 16 12:34:09 GMT 2023
Edited
by admin
on Sat Dec 16 12:34:09 GMT 2023
Record UNII
QG2KLY3KYW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Methoxy-4-nitrobenzoic acid
Systematic Name English
Benzoic acid, 3-methoxy-4-nitro-
Systematic Name English
4-Nitro-3-methoxybenzoic acid
Systematic Name English
NSC-148471
Code English
m-Anisic acid, 4-nitro-
Systematic Name English
Code System Code Type Description
NSC
148471
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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ECHA (EC/EINECS)
225-793-2
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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FDA UNII
QG2KLY3KYW
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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EPA CompTox
DTXSID50198840
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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CAS
5081-36-7
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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PUBCHEM
78764
Created by admin on Sat Dec 16 12:34:09 GMT 2023 , Edited by admin on Sat Dec 16 12:34:09 GMT 2023
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