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89745-95-9 | Benzene, 1-(2-chloro-2,3-diphenylcyclopropyl)-4-(1,1-dimethylethoxy)-
CAS No: 89745-95-9 Catalog No: AG004147 MDL No:
Product Description
Catalog Number:
AG004147
Chemical Name:
Benzene, 1-(2-chloro-2,3-diphenylcyclopropyl)-4-(1,1-dimethylethoxy)-
CAS Number:
89745-95-9
Molecular Formula:
C25H25ClO
Molecular Weight:
376.9184
IUPAC Name:
1-(2-chloro-2,3-diphenylcyclopropyl)-4-[(2-methylpropan-2-yl)oxy]benzene
InChI:
InChI=1S/C25H25ClO/c1-24(2,3)27-21-16-14-19(15-17-21)23-22(18-10-6-4-7-11-18)25(23,26)20-12-8-5-9-13-20/h4-17,22-23H,1-3H3
InChI Key:
ADUMJRGEZUZRNW-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C1C(C1(Cl)c1ccccc1)c1ccccc1)(C)C
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.159g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.924g/mol
Monoisotopic Mass:
376.159g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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