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Home > Fluorides > 1443323-45-2
1443323-45-2 | 3-Fluoro-4-[(4-thiomorpholino)methyl]thiophenol
CAS No: 1443323-45-2 Catalog No: AG01F9VK MDL No:
Product Description
Catalog Number:
AG01F9VK
Chemical Name:
3-Fluoro-4-[(4-thiomorpholino)methyl]thiophenol
CAS Number:
1443323-45-2
Molecular Formula:
C11H14FNS2
Molecular Weight:
243.3640
IUPAC Name:
3-fluoro-4-(thiomorpholin-4-ylmethyl)benzenethiol
InChI:
InChI=1S/C11H14FNS2/c12-11-7-10(14)2-1-9(11)8-13-3-5-15-6-4-13/h1-2,7,14H,3-6,8H2
InChI Key:
WEXHRBUHMYLTMH-UHFFFAOYSA-N
SMILES:
Sc1ccc(c(c1)F)CN1CCSCC1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.055g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.358g/mol
Monoisotopic Mass:
243.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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