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1443329-44-9 | 3-Chloro-6-ethoxyphenyl methyl sulfide
CAS No: 1443329-44-9 Catalog No: AG01FCR5 MDL No:
Product Description
Catalog Number:
AG01FCR5
Chemical Name:
3-Chloro-6-ethoxyphenyl methyl sulfide
CAS Number:
1443329-44-9
Molecular Formula:
C9H11ClOS
Molecular Weight:
202.7010
IUPAC Name:
4-chloro-1-ethoxy-2-methylsulfanylbenzene
InChI:
InChI=1S/C9H11ClOS/c1-3-11-8-5-4-7(10)6-9(8)12-2/h4-6H,3H2,1-2H3
InChI Key:
TXNGPMDHLMLJHX-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1SC)Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.696g/mol
Monoisotopic Mass:
202.022g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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