2,3,3-TRIMETHYLINDANONE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H14O
Molecular Weight	174.239
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,3,3-TRIMETHYLINDANONE

Structure Search

SMILES

CC1C(=O)C2=C(C=CC=C2)C1(C)C

InChI

InChIKey=KZSUMHASCAWKLE-UHFFFAOYSA-N

InChI=1S/C12H14O/c1-8-11(13)9-6-4-5-7-10(9)12(8,2)3/h4-8H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C12H14O
Molecular Weight	174.239
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:31:36 GMT 2025` Edited by `admin` on `Mon Mar 31 20:31:36 GMT 2025`
Record UNII	19D876M98B
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,3,3-TRIMETHYLINDANONE

Systematic Name

English

FEMA NO. 4556

Preferred Name

English

1H-INDEN-1-ONE, 2,3-DIHYDRO-2,3,3-TRIMETHYL-

Systematic Name

English

SAFFRON INDENONE

Common Name

English

2,3,3-TRIMETHYL-1-INDANONE

Systematic Name

English

SAFRALEINE

Common Name

English

1-INDANONE, 2,3,3-TRIMETHYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

19D876M98B

Created by admin on Mon Mar 31 20:31:36 GMT 2025 , Edited by admin on Mon Mar 31 20:31:36 GMT 2025

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EPA CompTox

DTXSID20886101

Created by admin on Mon Mar 31 20:31:36 GMT 2025 , Edited by admin on Mon Mar 31 20:31:36 GMT 2025

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CAS

54440-17-4

Created by admin on Mon Mar 31 20:31:36 GMT 2025 , Edited by admin on Mon Mar 31 20:31:36 GMT 2025

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PUBCHEM

10149036

Created by admin on Mon Mar 31 20:31:36 GMT 2025 , Edited by admin on Mon Mar 31 20:31:36 GMT 2025

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JECFA MONOGRAPH

2024

Created by admin on Mon Mar 31 20:31:36 GMT 2025 , Edited by admin on Mon Mar 31 20:31:36 GMT 2025

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