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138300-45-5 | 1H-Imidazole, 4,5-dichloro-1-[[4-(2-thienylmethoxy)phenoxy]methyl]-
CAS No: 138300-45-5 Catalog No: AG0018GW MDL No:
Product Description
Catalog Number:
AG0018GW
Chemical Name:
1H-Imidazole, 4,5-dichloro-1-[[4-(2-thienylmethoxy)phenoxy]methyl]-
CAS Number:
138300-45-5
Molecular Formula:
C15H12Cl2N2O2S
Molecular Weight:
355.2390
IUPAC Name:
4,5-dichloro-1-[[4-(thiophen-2-ylmethoxy)phenoxy]methyl]imidazole
InChI:
InChI=1S/C15H12Cl2N2O2S/c16-14-15(17)19(9-18-14)10-21-12-5-3-11(4-6-12)20-8-13-2-1-7-22-13/h1-7,9H,8,10H2
InChI Key:
VLJXUHDXHAKERA-UHFFFAOYSA-N
SMILES:
Clc1ncn(c1Cl)COc1ccc(cc1)OCc1cccs1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.233g/mol
Monoisotopic Mass:
354g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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