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13678-59-6 | Furan, 2-methyl-5-(methylthio)-
CAS No: 13678-59-6 Catalog No: AG0012CY MDL No:MFCD01208018
Product Description
Catalog Number:
AG0012CY
Chemical Name:
Furan, 2-methyl-5-(methylthio)-
CAS Number:
13678-59-6
Molecular Formula:
C6H8OS
Molecular Weight:
128.1921
MDL Number:
MFCD01208018
IUPAC Name:
2-methyl-5-methylsulfanylfuran
InChI:
InChI=1S/C6H8OS/c1-5-3-4-6(7-5)8-2/h3-4H,1-2H3
InChI Key:
RESBOJMQOGJOMW-UHFFFAOYSA-N
SMILES:
CSc1ccc(o1)C
EC Number:
237-170-2
UNII:
41Z7B950JJ
FEMA Number:
3366
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.03g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.189g/mol
Monoisotopic Mass:
128.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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