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88335-08-4 | Benzene, 1-phenoxy-3-[(5,5,5-trichloropentyl)oxy]-
CAS No: 88335-08-4 Catalog No: AG0047X5 MDL No:
Product Description
Catalog Number:
AG0047X5
Chemical Name:
Benzene, 1-phenoxy-3-[(5,5,5-trichloropentyl)oxy]-
CAS Number:
88335-08-4
Molecular Formula:
C17H17Cl3O2
Molecular Weight:
359.6747
IUPAC Name:
1-phenoxy-3-(5,5,5-trichloropentoxy)benzene
InChI:
InChI=1S/C17H17Cl3O2/c18-17(19,20)11-4-5-12-21-15-9-6-10-16(13-15)22-14-7-2-1-3-8-14/h1-3,6-10,13H,4-5,11-12H2
InChI Key:
XGYLLUVQPKAMSX-UHFFFAOYSA-N
SMILES:
ClC(CCCCOc1cccc(c1)Oc1ccccc1)(Cl)Cl
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.029g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
359.671g/mol
Monoisotopic Mass:
358.029g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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