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7511-65-1 | 3-(benzylsulfanyl)thiophene
CAS No: 7511-65-1 Catalog No: AG0056LC MDL No:
Product Description
Catalog Number:
AG0056LC
Chemical Name:
3-(benzylsulfanyl)thiophene
CAS Number:
7511-65-1
Molecular Formula:
C11H10S2
Molecular Weight:
206.3271
IUPAC Name:
3-benzylsulfanylthiophene
InChI:
InChI=1S/C11H10S2/c1-2-4-10(5-3-1)8-13-11-6-7-12-9-11/h1-7,9H,8H2
InChI Key:
RXFWJTQDRXCGPY-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CSc1cscc1
NSC Number:
32183
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.022g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.321g/mol
Monoisotopic Mass:
206.022g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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