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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O2
Molecular Weight 150.1745
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOIC ACID, 3-ETHYL-

SMILES

CCC1=CC(=CC=C1)C(O)=O

InChI

InChIKey=HXUSUAKIRZZMGP-UHFFFAOYSA-N
InChI=1S/C9H10O2/c1-2-7-4-3-5-8(6-7)9(10)11/h3-6H,2H2,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C9H10O2
Molecular Weight 150.1745
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 20:24:46 GMT 2023
Edited
by admin
on Fri Dec 15 20:24:46 GMT 2023
Record UNII
NK9G60IQ0A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIC ACID, 3-ETHYL-
Common Name English
NSC-59887
Code English
Code System Code Type Description
CAS
619-20-5
Created by admin on Fri Dec 15 20:24:46 GMT 2023 , Edited by admin on Fri Dec 15 20:24:46 GMT 2023
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NSC
59887
Created by admin on Fri Dec 15 20:24:46 GMT 2023 , Edited by admin on Fri Dec 15 20:24:46 GMT 2023
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PUBCHEM
96207
Created by admin on Fri Dec 15 20:24:46 GMT 2023 , Edited by admin on Fri Dec 15 20:24:46 GMT 2023
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FDA UNII
NK9G60IQ0A
Created by admin on Fri Dec 15 20:24:46 GMT 2023 , Edited by admin on Fri Dec 15 20:24:46 GMT 2023
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EPA CompTox
DTXSID40210924
Created by admin on Fri Dec 15 20:24:46 GMT 2023 , Edited by admin on Fri Dec 15 20:24:46 GMT 2023
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