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Home > Fluorides > 1379356-05-4
1379356-05-4 | 3,5-Difluoro-4-n-propoxythiophenol
CAS No: 1379356-05-4 Catalog No: AG01FE6O MDL No:
Product Description
Catalog Number:
AG01FE6O
Chemical Name:
3,5-Difluoro-4-n-propoxythiophenol
CAS Number:
1379356-05-4
Molecular Formula:
C9H10F2OS
Molecular Weight:
204.2369
IUPAC Name:
3,5-difluoro-4-propoxybenzenethiol
InChI:
InChI=1S/C9H10F2OS/c1-2-3-12-9-7(10)4-6(13)5-8(9)11/h4-5,13H,2-3H2,1H3
InChI Key:
RZLCWVZVVCPSBH-UHFFFAOYSA-N
SMILES:
CCCOc1c(F)cc(cc1F)S
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.042g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.235g/mol
Monoisotopic Mass:
204.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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