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Details

Stereochemistry ACHIRAL
Molecular Formula C16H12O3
Molecular Weight 252.2647
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXY-3-BENZYLCOUMARIN

SMILES

OC1=C(CC2=CC=CC=C2)C(=O)OC3=CC=CC=C13

InChI

InChIKey=AEIVRFFWQSJCAR-UHFFFAOYSA-N
InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2

HIDE SMILES / InChI

Molecular Formula C16H12O3
Molecular Weight 252.2647
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 15:32:15 GMT 2023
Edited
by admin
on Sat Dec 16 15:32:15 GMT 2023
Record UNII
KV6AJ39594
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXY-3-BENZYLCOUMARIN
Common Name English
2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(PHENYLMETHYL)-
Systematic Name English
4-HYDROXY-3-(PHENYLMETHYL)-2H-1-BENZOPYRAN-2-ONE
Systematic Name English
3-BENZYL-4-HYDROXYCOUMARIN
Common Name English
COUMARIN, 3-BENZYL-4-HYDROXY-
Common Name English
4-OXIDANYL-3-(PHENYLMETHYL)CHROMEN-2-ONE
Systematic Name English
3-BENZYL-4-HYDROXY-2H-1-BENZOPYRAN-2-ONE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60715769
Created by admin on Sat Dec 16 15:32:15 GMT 2023 , Edited by admin on Sat Dec 16 15:32:15 GMT 2023
PRIMARY
CAS
15074-18-7
Created by admin on Sat Dec 16 15:32:15 GMT 2023 , Edited by admin on Sat Dec 16 15:32:15 GMT 2023
PRIMARY
FDA UNII
KV6AJ39594
Created by admin on Sat Dec 16 15:32:15 GMT 2023 , Edited by admin on Sat Dec 16 15:32:15 GMT 2023
PRIMARY
PUBCHEM
54686112
Created by admin on Sat Dec 16 15:32:15 GMT 2023 , Edited by admin on Sat Dec 16 15:32:15 GMT 2023
PRIMARY