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Home > Fluorides > 1378964-10-3
1378964-10-3 | 4-Fluoro-2-[(n-propyloxy)methyl]thiophenol
CAS No: 1378964-10-3 Catalog No: AG01FB9K MDL No:
Product Description
Catalog Number:
AG01FB9K
Chemical Name:
4-Fluoro-2-[(n-propyloxy)methyl]thiophenol
CAS Number:
1378964-10-3
Molecular Formula:
C10H13FOS
Molecular Weight:
200.2730
IUPAC Name:
4-fluoro-2-(propoxymethyl)benzenethiol
InChI:
InChI=1S/C10H13FOS/c1-2-5-12-7-8-6-9(11)3-4-10(8)13/h3-4,6,13H,2,5,7H2,1H3
InChI Key:
HWIFOIPHRSLJJK-UHFFFAOYSA-N
SMILES:
CCCOCc1cc(F)ccc1S
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:
1
Isotope Atom Count:
0
Molecular Weight:
200.271g/mol
Monoisotopic Mass:
200.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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