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89861-09-6 | 3-Furanmethanol, 2-(phenylthio)-
CAS No: 89861-09-6 Catalog No: AG003X27 MDL No:
Product Description
Catalog Number:
AG003X27
Chemical Name:
3-Furanmethanol, 2-(phenylthio)-
CAS Number:
89861-09-6
Molecular Formula:
C11H10O2S
Molecular Weight:
206.2609
IUPAC Name:
(2-phenylsulfanylfuran-3-yl)methanol
InChI:
InChI=1S/C11H10O2S/c12-8-9-6-7-13-11(9)14-10-4-2-1-3-5-10/h1-7,12H,8H2
InChI Key:
JLPFWJSPBKXFST-UHFFFAOYSA-N
SMILES:
OCc1ccoc1Sc1ccccc1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.259g/mol
Monoisotopic Mass:
206.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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