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72462-74-9 | ETHYL 2-(2,3,5,6-TETRAMETHYLPHENYL)SULFANYLPROPANOATE
CAS No: 72462-74-9 Catalog No: AG005HFD MDL No:
Product Description
Catalog Number:
AG005HFD
Chemical Name:
ETHYL 2-(2,3,5,6-TETRAMETHYLPHENYL)SULFANYLPROPANOATE
CAS Number:
72462-74-9
Molecular Formula:
C15H22O2S
Molecular Weight:
266.3990
IUPAC Name:
ethyl 2-(2,3,5,6-tetramethylphenyl)sulfanylpropanoate
InChI:
InChI=1S/C15H22O2S/c1-7-17-15(16)13(6)18-14-11(4)9(2)8-10(3)12(14)5/h8,13H,7H2,1-6H3
InChI Key:
YUEVLBYIGQONEJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Sc1c(C)c(C)cc(c1C)C)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.399g/mol
Monoisotopic Mass:
266.134g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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