名称: 1-[(4-tert-butyl-2-methylcyclopenta-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]-4-chlorobenzene
SMILES:
CC1=CC(=CC1=C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(C)(C)CMolecular Processing
Molecular formula
C23H22Cl2
Molecular weight
369.34
Exact mass
368.1099
XLogP
7.73
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
2
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
110.22
Supplementary Information
InChIKey: OYEDONMCIZLYPS-UHFFFAOYSA-N
同義語
SCHEMBL2272431OYEDONMCIZLYPS-UHFFFAOYSA-N3-tert-butyl-1-methyl-6,6-di(4-chloro -phenyl)fulvene3-tert-butyl-1-methyl-6,6-di(4-chloro-phenyl)fulvene
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