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24565-55-7 | Thiophene, 3-(diethoxymethyl)-2-(ethylthio)-
CAS No: 24565-55-7 Catalog No: AG002OKA MDL No:
Product Description
Catalog Number:
AG002OKA
Chemical Name:
Thiophene, 3-(diethoxymethyl)-2-(ethylthio)-
CAS Number:
24565-55-7
Molecular Formula:
C11H18O2S2
Molecular Weight:
246.3894
IUPAC Name:
3-(diethoxymethyl)-2-ethylsulfanylthiophene
InChI:
InChI=1S/C11H18O2S2/c1-4-12-10(13-5-2)9-7-8-15-11(9)14-6-3/h7-8,10H,4-6H2,1-3H3
InChI Key:
MGJCUGSKXYNZDN-UHFFFAOYSA-N
SMILES:
CCOC(c1ccsc1SCC)OCC
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.075g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.383g/mol
Monoisotopic Mass:
246.075g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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