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Home > Fluorides > 1379351-13-9
1379351-13-9 | 5-Fluoro-2-n-propoxyphenyl methyl sulfide
CAS No: 1379351-13-9 Catalog No: AG01FBMB MDL No:
Product Description
Catalog Number:
AG01FBMB
Chemical Name:
5-Fluoro-2-n-propoxyphenyl methyl sulfide
CAS Number:
1379351-13-9
Molecular Formula:
C10H13FOS
Molecular Weight:
200.2730
IUPAC Name:
4-fluoro-2-methylsulfanyl-1-propoxybenzene
InChI:
InChI=1S/C10H13FOS/c1-3-6-12-9-5-4-8(11)7-10(9)13-2/h4-5,7H,3,6H2,1-2H3
InChI Key:
CZOQOMMAXXYLBA-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1SC)F
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.271g/mol
Monoisotopic Mass:
200.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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