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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6O5.2Na
Molecular Weight 228.1098
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DISODIUM 7-OXABICYCLO(2.2.1)HEPT-5-ENE-2,3-DICARBOXYLATE, (ENDO,ENDO)-

SMILES

[Na+].[Na+].[O-]C(=O)[C@H]1[C@@H]2O[C@@H](C=C2)[C@H]1C([O-])=O

InChI

InChIKey=ZRHKGBGEZJYZAY-RCEHDPCYSA-L
InChI=1S/C8H8O5.2Na/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;;/h1-6H,(H,9,10)(H,11,12);;/q;2*+1/p-2/t3-,4+,5+,6-;;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H6O5
Molecular Weight 182.1302
Charge -2
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:55:15 GMT 2023
Edited
by admin
on Sat Dec 16 07:55:15 GMT 2023
Record UNII
5SG2WQT857
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DISODIUM 7-OXABICYCLO(2.2.1)HEPT-5-ENE-2,3-DICARBOXYLATE, (ENDO,ENDO)-
Common Name English
7-OXABICYCLO(2.2.1)HEPT-5-ENE-2,3-DICARBOXYLIC ACID, DISODIUM SALT, (ENDO,ENDO)-
Systematic Name English
(ENDO,ENDO)-DISODIUM 7-OXABICYCLO(2.2.1)HEPT-5-ENE-2,3-DICARBOXYLATE
Common Name English
7-OXABICYCLO(2.2.1)HEPT-5-ENE-2,3-DICARBOXYLIC ACID, DISODIUM SALT, ENDO-
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 38910
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID6041189
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
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CAS
6385-60-0
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
PRIMARY
ECHA (EC/EINECS)
228-984-9
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
PRIMARY
PUBCHEM
92226
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
PRIMARY
FDA UNII
5SG2WQT857
Created by admin on Sat Dec 16 07:55:15 GMT 2023 , Edited by admin on Sat Dec 16 07:55:15 GMT 2023
PRIMARY