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Home > Fluorides > 1443324-29-5
1443324-29-5 | 4-[(Cyclohexanemethoxy)methyl]-3-fluorothiophenol
CAS No: 1443324-29-5 Catalog No: AG01F9BC MDL No:
Product Description
Catalog Number:
AG01F9BC
Chemical Name:
4-[(Cyclohexanemethoxy)methyl]-3-fluorothiophenol
CAS Number:
1443324-29-5
Molecular Formula:
C14H19FOS
Molecular Weight:
254.3635
IUPAC Name:
4-(cyclohexylmethoxymethyl)-3-fluorobenzenethiol
InChI:
InChI=1S/C14H19FOS/c15-14-8-13(17)7-6-12(14)10-16-9-11-4-2-1-3-5-11/h6-8,11,17H,1-5,9-10H2
InChI Key:
TXUDZIBFKXVUQM-UHFFFAOYSA-N
SMILES:
Sc1ccc(c(c1)F)COCC1CCCCC1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.114g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.363g/mol
Monoisotopic Mass:
254.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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