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Details

Stereochemistry RACEMIC
Molecular Formula C10H10O4
Molecular Weight 194.184
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DIHYDRO-3,8-DIHYDROXY-3-METHYLISOCOUMARIN

SMILES

CC1(O)CC2=CC=CC(O)=C2C(=O)O1

InChI

InChIKey=SDGOMJUKDHSPPU-UHFFFAOYSA-N
InChI=1S/C10H10O4/c1-10(13)5-6-3-2-4-7(11)8(6)9(12)14-10/h2-4,11,13H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H10O4
Molecular Weight 194.184
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:17:15 GMT 2023
Edited
by admin
on Sat Dec 16 12:17:15 GMT 2023
Record UNII
IAA7ET557X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DIHYDRO-3,8-DIHYDROXY-3-METHYLISOCOUMARIN
Systematic Name English
ISOCOUMARIN, 3,4-DIHYDRO-3,8-DIHYDROXY-3-METHYL-
Systematic Name English
3,8-DIHYDROXY-3-METHYLISOCHROMAN-1-ONE
Systematic Name English
3-METHYL-3,8-DIHYDROXY-3,4-DIHYDROISOCOUMARIN
Systematic Name English
1H-2-BENZOPYRAN-1-ONE, 3,4-DIHYDRO-3,8-DIHYDROXY-3-METHYL-
Systematic Name English
3,4-DIHYDRO-3,8-DIHYDROXY-3-METHYL-1H-2-BENZOPYRAN-1-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20953064
Created by admin on Sat Dec 16 12:17:15 GMT 2023 , Edited by admin on Sat Dec 16 12:17:15 GMT 2023
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CAS
30888-05-2
Created by admin on Sat Dec 16 12:17:15 GMT 2023 , Edited by admin on Sat Dec 16 12:17:15 GMT 2023
PRIMARY
FDA UNII
IAA7ET557X
Created by admin on Sat Dec 16 12:17:15 GMT 2023 , Edited by admin on Sat Dec 16 12:17:15 GMT 2023
PRIMARY
PUBCHEM
93142
Created by admin on Sat Dec 16 12:17:15 GMT 2023 , Edited by admin on Sat Dec 16 12:17:15 GMT 2023
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