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137717-87-4 | Furan, 2-methyl-3-(thienyldithio)- (9CI)
CAS No: 137717-87-4 Catalog No: AG0013R8 MDL No:
Product Description
Catalog Number:
AG0013R8
Chemical Name:
Furan, 2-methyl-3-(thienyldithio)- (9CI)
CAS Number:
137717-87-4
Molecular Formula:
C9H8OS3
Molecular Weight:
228.3542
IUPAC Name:
2-methyl-3-(thiophen-2-yldisulfanyl)furan
InChI:
InChI=1S/C9H8OS3/c1-7-8(4-5-10-7)12-13-9-3-2-6-11-9/h2-6H,1H3
InChI Key:
ZFBKAHLRVLZPJP-UHFFFAOYSA-N
SMILES:
Cc1occc1SSc1cccs1
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.342g/mol
Monoisotopic Mass:
227.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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