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61197-09-9 | 2-Methyl-3-(propyldisulfanyl)furan
CAS No: 61197-09-9 Catalog No: AG003TZP MDL No:MFCD01729816
Product Description
Catalog Number:
AG003TZP
Chemical Name:
2-Methyl-3-(propyldisulfanyl)furan
CAS Number:
61197-09-9
Molecular Formula:
C8H12OS2
Molecular Weight:
188.3103
MDL Number:
MFCD01729816
IUPAC Name:
2-methyl-3-(propyldisulfanyl)furan
InChI:
InChI=1S/C8H12OS2/c1-3-6-10-11-8-4-5-9-7(8)2/h4-5H,3,6H2,1-2H3
InChI Key:
YFPPCUTVJGGSQC-UHFFFAOYSA-N
SMILES:
CCCSSc1ccoc1C
EC Number:
262-650-3
UNII:
L68JIN0W7Q
FEMA Number:
3607
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.033g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.303g/mol
Monoisotopic Mass:
188.033g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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