Chem
J-GLOBAL ID：200907022129703737
Nikkaji number：J2.574.246J
Bis(3,6-ditert-butylazulene-1-yl) ketone
ビス(3,6-ジtert-ブチルアズレン-1-イル)ケトン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C37H46O
Molecular formula furigana： C37-H46-O
Molecular weight： 506.774
InChI：
InChI=1S/C37H46O/c1-34(2,3)23-13-17-25-27(19-15-23)31(36(7,8)9)21-29(25)33(38)30-22-32(37(10,11)12)28-20-16-24(35(4,5)6)14-18-26(28)30/h13-22H,1-12H3
InChI key：
GJKQKATWDFXNFL-UHFFFAOYSA-N
SMILES：
CC(C)(C)c1cc(C(=O)c2cc(c3ccc(ccc23)C(C)(C)C)C(C)(C)C)c2ccc(ccc12)C(C)(C)C
Systematic name (3)：
- ビス(3,6-ジtert-ブチルアズレン-1-イル)ケトン
- ビス(3,6-ジ-tert-ブチルアズレン-1-イル)メタノン
- bis(3,6-di-tert-butylazulen-1-yl)methanone
- Bis(3,6-ditert-butylazulene-1-yl) ketone
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