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Details

Stereochemistry ACHIRAL
Molecular Formula C13H15NO2
Molecular Weight 217.2637
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COUMARIN 2

SMILES

CCNC1=CC2=C(C=C1C)C(C)=CC(=O)O2

InChI

InChIKey=QZXAEJGHNXJTSE-UHFFFAOYSA-N
InChI=1S/C13H15NO2/c1-4-14-11-7-12-10(5-9(11)3)8(2)6-13(15)16-12/h5-7,14H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H15NO2
Molecular Weight 217.2637
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 09:36:09 GMT 2023
Edited
by admin
on Sat Dec 16 09:36:09 GMT 2023
Record UNII
K6QVX5PW75
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COUMARIN 2
Common Name English
COUMARIN, 7-(ETHYLAMINO)-4,6-DIMETHYL-
Systematic Name English
2H-1-BENZOPYRAN-2-ONE, 7-(ETHYLAMINO)-4,6-DIMETHYL-
Systematic Name English
7-(ETHYLAMINO)-4,6-DIMETHYLCOUMARIN
Systematic Name English
4,6-DIMETHYL-7-(ETHYLAMINO)COUMARIN
Systematic Name English
NSC-93963
Code English
7-(ETHYLAMINO)-4,6-DIMETHYL-2H-1-BENZOPYRAN-2-ONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
247-446-4
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY
PUBCHEM
96929
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID20885331
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY
NSC
93963
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY
CAS
26078-25-1
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY
FDA UNII
K6QVX5PW75
Created by admin on Sat Dec 16 09:36:09 GMT 2023 , Edited by admin on Sat Dec 16 09:36:09 GMT 2023
PRIMARY