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164979-74-2 | Ethyl 2-(2-methoxyphenyl)sulfanylacetate
CAS No: 164979-74-2 Catalog No: AG01FC3Q MDL No:MFCD14617984
Product Description
Catalog Number:
AG01FC3Q
Chemical Name:
Ethyl 2-(2-methoxyphenyl)sulfanylacetate
CAS Number:
164979-74-2
Molecular Formula:
C11H14O3S
Molecular Weight:
226.2921
MDL Number:
MFCD14617984
IUPAC Name:
ethyl 2-(2-methoxyphenyl)sulfanylacetate
InChI:
InChI=1S/C11H14O3S/c1-3-14-11(12)8-15-10-7-5-4-6-9(10)13-2/h4-7H,3,8H2,1-2H3
InChI Key:
BPMBKCDYXZLFNV-UHFFFAOYSA-N
SMILES:
CCOC(=O)CSc1ccccc1OC
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.066g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.29g/mol
Monoisotopic Mass:
226.066g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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