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Details

Stereochemistry ACHIRAL
Molecular Formula C40H50P2.2Cl
Molecular Weight 663.679
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-methylbut-2-enyl-[6-[3-methylbut-2-enyl(diphenyl)phosphaniumyl]hexyl]-diphenylphosphanium chloride

SMILES

[Cl-].[Cl-].CC(C)=CC[P+](CCCCCC[P+](CC=C(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=ANWGCLHZHIVKJI-UHFFFAOYSA-L
InChI=1S/C40H50P2.2ClH/c1-35(2)29-33-41(37-21-11-7-12-22-37,38-23-13-8-14-24-38)31-19-5-6-20-32-42(34-30-36(3)4,39-25-15-9-16-26-39)40-27-17-10-18-28-40;;/h7-18,21-30H,5-6,19-20,31-34H2,1-4H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C40H50P2
Molecular Weight 592.7725
Charge 2
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 Wed Apr 02 14:50:09 GMT 2025
Edited
by admin
on Wed Apr 02 14:50:09 GMT 2025
Record UNII
2VS3ZQH3EF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-329339
Preferred Name English
3-methylbut-2-enyl-[6-[3-methylbut-2-enyl(diphenyl)phosphaniumyl]hexyl]-diphenylphosphanium chloride
Systematic Name English
Phosphonium, 1,6-hexanediylbis[(3-methyl-2-butenyl)diphenyl-, dichloride
Systematic Name English
Hexane-1,6-diylbis((3-methylbut-2-en-1-yl)diphenylphosphonium) chloride
Systematic Name English
Code System Code Type Description
PUBCHEM
127256375
Created by admin on Wed Apr 02 14:50:09 GMT 2025 , Edited by admin on Wed Apr 02 14:50:09 GMT 2025
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NSC
329339
Created by admin on Wed Apr 02 14:50:09 GMT 2025 , Edited by admin on Wed Apr 02 14:50:09 GMT 2025
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EPA CompTox
DTXSID80230929
Created by admin on Wed Apr 02 14:50:09 GMT 2025 , Edited by admin on Wed Apr 02 14:50:09 GMT 2025
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FDA UNII
2VS3ZQH3EF
Created by admin on Wed Apr 02 14:50:09 GMT 2025 , Edited by admin on Wed Apr 02 14:50:09 GMT 2025
PRIMARY
CAS
81194-93-6
Created by admin on Wed Apr 02 14:50:09 GMT 2025 , Edited by admin on Wed Apr 02 14:50:09 GMT 2025
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