Coumarin 153

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H14F3NO2
Molecular Weight	309.2831
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC(F)(F)C1=CC(=O)OC2=C1C=C3CCCN4CCCC2=C34

InChI

InChIKey=VSSSHNJONFTXHS-UHFFFAOYSA-N

InChI=1S/C16H14F3NO2/c17-16(18,19)12-8-13(21)22-15-10-4-2-6-20-5-1-3-9(14(10)20)7-11(12)15/h7-8H,1-6H2

HIDE SMILES / InChI

Molecular Formula	C16H14F3NO2
Molecular Weight	309.2831
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 `Tue Apr 01 19:11:52 GMT 2025` Edited by `admin` on `Tue Apr 01 19:11:52 GMT 2025`
Record UNII	BC3BHZ527V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-338964

Preferred Name

English

Coumarin 153

Common Name

English

Coumarin 6F

Common Name

English

2,3,6,7-Tetrahydro-9-(trifluoromethyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one

Systematic Name

English

1H,5H,11H-(1)BENZOPYRANO(6,7,8-IJ)QUINOLIZIN-11-ONE, 2,3,6,7-TETRAHYDRO-9-(TRIFLUOROMETHYL)-

Systematic Name

English

8-TrifluoromethylL-2,3,5,6-tetrahydro-1H,4H-11-oxa-3A-aza-benzo[DE]anthrecen-10-one

Systematic Name

English

K-153

Code

English

Pilot 495

Common Name

English

6-(trifluoromethyl)-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),5,8-tetraen-4-one

Systematic Name

English

Coumarin 495

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID0068864