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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12I2O3
Molecular Weight 446.0201
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYL 4-HYDROXY-3,5-DIIODOBENZOATE

SMILES

CCCCOC(=O)C1=CC(I)=C(O)C(I)=C1

InChI

InChIKey=AKPGOBAFPMFHET-UHFFFAOYSA-N
InChI=1S/C11H12I2O3/c1-2-3-4-16-11(15)7-5-8(12)10(14)9(13)6-7/h5-6,14H,2-4H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H12I2O3
Molecular Weight 446.0201
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:53:58 GMT 2023
Edited
by admin
on Fri Dec 15 18:53:58 GMT 2023
Record UNII
MVG10P6621
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTYL 4-HYDROXY-3,5-DIIODOBENZOATE
Systematic Name English
BUTYL 3,5-DIIODO-4-HYDROXYBENZOATE
Systematic Name English
BENZOIC ACID, 4-HYDROXY-3,5-DIIODO-, BUTYL ESTER
Common Name English
N-BUTYL 4-HYDROXY-3,5-DIIODOBENZOATE
Common Name English
N-BUTYL-3,5-DIIODO-4-HYDROXYBENZOATE
Common Name English
NSC-60235
Code English
Code System Code Type Description
ECHA (EC/EINECS)
200-094-5
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY
CAS
51-38-7
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY
PUBCHEM
65511
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID80198999
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY
NSC
60235
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY
FDA UNII
MVG10P6621
Created by admin on Fri Dec 15 18:53:58 GMT 2023 , Edited by admin on Fri Dec 15 18:53:58 GMT 2023
PRIMARY