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Details

Stereochemistry ACHIRAL
Molecular Formula C30H34
Molecular Weight 394.591
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3'-DIGUAIAZULENE

SMILES

CC(C)C1=CC=C(C)C2=C(C=C(C)C2=C1)C3=C4C(=CC(=CC=C4C)C(C)C)C(C)=C3

InChI

InChIKey=LTZKCSOVQXLBIG-UHFFFAOYSA-N
InChI=1S/C30H34/c1-17(2)23-11-9-19(5)29-25(15-23)21(7)13-27(29)28-14-22(8)26-16-24(18(3)4)12-10-20(6)30(26)28/h9-18H,1-8H3

HIDE SMILES / InChI

Molecular Formula C30H34
Molecular Weight 394.591
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 09:00:45 GMT 2023
Edited
by admin
on Sat Dec 16 09:00:45 GMT 2023
Record UNII
NG3VU0Q1OA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3'-DIGUAIAZULENE
Common Name English
3,3'-BIGUAIAZULENE
Common Name English
1,1'-BIAZULENE, 3,3',8,8'-TETRAMETHYL-5,5'-BIS(1-METHYLETHYL)-
Systematic Name English
1,1'-BIAZULENE, 5,5'-DIISOPROPYL-3,3',8,8'-TETRAMETHYL-
Systematic Name English
Code System Code Type Description
CAS
17509-79-4
Created by admin on Sat Dec 16 09:00:45 GMT 2023 , Edited by admin on Sat Dec 16 09:00:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID90348266
Created by admin on Sat Dec 16 09:00:45 GMT 2023 , Edited by admin on Sat Dec 16 09:00:45 GMT 2023
PRIMARY
PUBCHEM
633841
Created by admin on Sat Dec 16 09:00:45 GMT 2023 , Edited by admin on Sat Dec 16 09:00:45 GMT 2023
PRIMARY
FDA UNII
NG3VU0Q1OA
Created by admin on Sat Dec 16 09:00:45 GMT 2023 , Edited by admin on Sat Dec 16 09:00:45 GMT 2023
PRIMARY