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Details

Stereochemistry ACHIRAL
Molecular Formula C55H66
Molecular Weight 727.1125
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,4,5-PENTAKIS(4-BUTYLPHENYL)-1,3-CYCLOPENTADIENE

SMILES

CCCCC1=CC=C(C=C1)C2C(=C(C(=C2C3=CC=C(CCCC)C=C3)C4=CC=C(CCCC)C=C4)C5=CC=C(CCCC)C=C5)C6=CC=C(CCCC)C=C6

InChI

InChIKey=CZMWDGMAEHAEDB-UHFFFAOYSA-N
InChI=1S/C55H66/c1-6-11-16-41-21-31-46(32-22-41)51-52(47-33-23-42(24-34-47)17-12-7-2)54(49-37-27-44(28-38-49)19-14-9-4)55(50-39-29-45(30-40-50)20-15-10-5)53(51)48-35-25-43(26-36-48)18-13-8-3/h21-40,51H,6-20H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C55H66
Molecular Weight 727.1125
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 18:15:53 GMT 2023
Edited
by admin
on Sat Dec 16 18:15:53 GMT 2023
Record UNII
YZ6AHM38KB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,4,5-PENTAKIS(4-BUTYLPHENYL)-1,3-CYCLOPENTADIENE
Common Name English
1,1,1,1,1-(1,3-CYCLOPENTADIENE-1,2,3,4,5-PENTAYL)PENTAKIS(4-BUTYLBENZENE)
Systematic Name English
BENZENE, 1,1,1,1,1-(1,3-CYCLOPENTADIENE-1,2,3,4,5-PENTAYL)PENTAKIS(4-BUTYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID601129639
Created by admin on Sat Dec 16 18:15:53 GMT 2023 , Edited by admin on Sat Dec 16 18:15:53 GMT 2023
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WIKIPEDIA
1,2,3,4,5-Pentakis(4-butylphenyl)-1,3-cyclopentadiene
Created by admin on Sat Dec 16 18:15:53 GMT 2023 , Edited by admin on Sat Dec 16 18:15:53 GMT 2023
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CAS
161296-28-2
Created by admin on Sat Dec 16 18:15:53 GMT 2023 , Edited by admin on Sat Dec 16 18:15:53 GMT 2023
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PUBCHEM
102025217
Created by admin on Sat Dec 16 18:15:53 GMT 2023 , Edited by admin on Sat Dec 16 18:15:53 GMT 2023
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FDA UNII
YZ6AHM38KB
Created by admin on Sat Dec 16 18:15:53 GMT 2023 , Edited by admin on Sat Dec 16 18:15:53 GMT 2023
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