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1443305-74-5

1443305-74-5 | 4-Fluoro-2-[(1-piperidino)methyl]thiophenol

CAS No: 1443305-74-5 Catalog No: AG01FAZA MDL No:

Product Description

Catalog Number:
AG01FAZA
Chemical Name:
4-Fluoro-2-[(1-piperidino)methyl]thiophenol
CAS Number:
1443305-74-5
Molecular Formula:
C12H16FNS
Molecular Weight:
225.3255
IUPAC Name:
4-fluoro-2-(piperidin-1-ylmethyl)benzenethiol
InChI:
InChI=1S/C12H16FNS/c13-11-4-5-12(15)10(8-11)9-14-6-2-1-3-7-14/h4-5,8,15H,1-3,6-7,9H2
InChI Key:
VDTJLTQADPBPRT-UHFFFAOYSA-N
SMILES:
Sc1ccc(cc1CN1CCCCC1)F

Properties

Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.099g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.325g/mol
Monoisotopic Mass:
225.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
4.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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