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1378783-21-1 | 4-Fluoro-2-n-propoxythiophenol
CAS No: 1378783-21-1 Catalog No: AG01FF1N MDL No:
Product Description
Catalog Number:
AG01FF1N
Chemical Name:
4-Fluoro-2-n-propoxythiophenol
CAS Number:
1378783-21-1
Molecular Formula:
C9H11FOS
Molecular Weight:
186.2464
IUPAC Name:
4-fluoro-2-propoxybenzenethiol
InChI:
InChI=1S/C9H11FOS/c1-2-5-11-8-6-7(10)3-4-9(8)12/h3-4,6,12H,2,5H2,1H3
InChI Key:
KGWZGPOOHBEADU-UHFFFAOYSA-N
SMILES:
CCCOc1cc(F)ccc1S
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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