2,4,6-TRIS(3,5-DI-TERT-BUTYLCYCLOHEXA-2,5-DIEN-4-ON-1-YLIDINEMETHYL)MESITYLENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C54H72O3
Molecular Weight	769.1477
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4,6-TRIS(3,5-DI-TERT-BUTYLCYCLOHEXA-2,5-DIEN-4-ON-1-YLIDINEMETHYL)MESITYLENE

Structure Search

SMILES

CC1=C(C=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C(C)=C(C=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(C)=C1C=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C

InChI

InChIKey=VDDPNGNCUBSZKJ-UHFFFAOYSA-N

InChI=1S/C54H72O3/c1-31-37(22-34-25-40(49(4,5)6)46(55)41(26-34)50(7,8)9)32(2)39(24-36-29-44(53(16,17)18)48(57)45(30-36)54(19,20)21)33(3)38(31)23-35-27-42(51(10,11)12)47(56)43(28-35)52(13,14)15/h22-30H,1-21H3

HIDE SMILES / InChI

Molecular Formula	C54H72O3
Molecular Weight	769.1477
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 11:59:13 GMT 2023` Edited by `admin` on `Sat Dec 16 11:59:13 GMT 2023`
Record UNII	0JDS4DRO0K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4,6-TRIS(3,5-DI-TERT-BUTYLCYCLOHEXA-2,5-DIEN-4-ON-1-YLIDINEMETHYL)MESITYLENE

Systematic Name

English

2,5-CYCLOHEXADIEN-1-ONE, 4,4',4''-((2,4,6-TRIMETHYL-1,3,5-BENZENETRIYL)TRIMETHYLIDYNE)TRIS(2,6-BIS(1,1-DIMETHYLETHYL)-

Systematic Name

English

4,4',4''-((2,4,6-TRIMETHYL-S-PHENENYLENE)TRIMETHYLIDYNE)TRIS(2,6-DI-TERT-BUTYL-2,5-CYCLOHEXADIENONE)

Systematic Name

English

Code System Code Type Description

PUBCHEM

53440241

Created by admin on Sat Dec 16 11:59:13 GMT 2023 , Edited by admin on Sat Dec 16 11:59:13 GMT 2023

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FDA UNII

0JDS4DRO0K

Created by admin on Sat Dec 16 11:59:13 GMT 2023 , Edited by admin on Sat Dec 16 11:59:13 GMT 2023

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EPA CompTox

DTXSID10702442

Created by admin on Sat Dec 16 11:59:13 GMT 2023 , Edited by admin on Sat Dec 16 11:59:13 GMT 2023

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CAS

20357-51-1

Created by admin on Sat Dec 16 11:59:13 GMT 2023 , Edited by admin on Sat Dec 16 11:59:13 GMT 2023

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