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Details

Stereochemistry ACHIRAL
Molecular Formula C32H48O2
Molecular Weight 464.7223
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,5,3',5'-Tetrakis-(2,2-dimethyl-propyl)-bicyclohexylidene-2,5,2',5'-tetraene-4,4'-dione

SMILES

CC(C)(C)CC1=CC(C=C(CC(C)(C)C)C1=O)=C2C=C(CC(C)(C)C)C(=O)C(CC(C)(C)C)=C2

InChI

InChIKey=HQZKZUYIGKIWDZ-UHFFFAOYSA-N
InChI=1S/C32H48O2/c1-29(2,3)17-23-13-21(14-24(27(23)33)18-30(4,5)6)22-15-25(19-31(7,8)9)28(34)26(16-22)20-32(10,11)12/h13-16H,17-20H2,1-12H3

HIDE SMILES / InChI

Molecular Formula C32H48O2
Molecular Weight 464.7223
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 20:14:08 GMT 2025
Edited
by admin
on Tue Apr 01 20:14:08 GMT 2025
Record UNII
V9J29GVA7Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-14481
Preferred Name English
3,5,3',5'-Tetrakis-(2,2-dimethyl-propyl)-bicyclohexylidene-2,5,2',5'-tetraene-4,4'-dione
Systematic Name English
4-[3,5-Bis(2,2-dimethylpropyl)-4-oxo-2,5-cyclohexadien-1-ylidene]-2,6-bis(2,2-dimethylpropyl)-2,5-cyclohexadien-1-one
Systematic Name English
2,5-Cyclohexadien-1-one, 4-[3,5-bis(2,2-dimethylpropyl)-4-oxo-2,5-cyclohexadien-1-ylidene]-2,6-bis(2,2-dimethylpropyl)-
Systematic Name English
[Bi-2,5-cyclohexadien-1-ylidene]-4,4?-dione, 3,3?,5,5?-tetraneopentyl-
Systematic Name English
Code System Code Type Description
CAS
5450-53-3
Created by admin on Tue Apr 01 20:14:08 GMT 2025 , Edited by admin on Tue Apr 01 20:14:08 GMT 2025
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FDA UNII
V9J29GVA7Q
Created by admin on Tue Apr 01 20:14:08 GMT 2025 , Edited by admin on Tue Apr 01 20:14:08 GMT 2025
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PUBCHEM
225285
Created by admin on Tue Apr 01 20:14:08 GMT 2025 , Edited by admin on Tue Apr 01 20:14:08 GMT 2025
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EPA CompTox
DTXSID90202910
Created by admin on Tue Apr 01 20:14:08 GMT 2025 , Edited by admin on Tue Apr 01 20:14:08 GMT 2025
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NSC
14481
Created by admin on Tue Apr 01 20:14:08 GMT 2025 , Edited by admin on Tue Apr 01 20:14:08 GMT 2025
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