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1379278-98-4 | 4-Fluoro-3-n-propoxythiophenol
CAS No: 1379278-98-4 Catalog No: AG01FF1Y MDL No:
Product Description
Catalog Number:
AG01FF1Y
Chemical Name:
4-Fluoro-3-n-propoxythiophenol
CAS Number:
1379278-98-4
Molecular Formula:
C9H11FOS
Molecular Weight:
186.2464
IUPAC Name:
4-fluoro-3-propoxybenzenethiol
InChI:
InChI=1S/C9H11FOS/c1-2-5-11-9-6-7(12)3-4-8(9)10/h3-4,6,12H,2,5H2,1H3
InChI Key:
YICNFNUCYOIHKP-UHFFFAOYSA-N
SMILES:
CCCOc1cc(S)ccc1F
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.244g/mol
Monoisotopic Mass:
186.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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