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13108-97-9 | Pyridine, 2,3,5-trichloro-4-(propylsulfinyl)-
CAS No: 13108-97-9 Catalog No: AG000VI7 MDL No:
Product Description
Catalog Number:
AG000VI7
Chemical Name:
Pyridine, 2,3,5-trichloro-4-(propylsulfinyl)-
CAS Number:
13108-97-9
Molecular Formula:
C8H8Cl3NOS
Molecular Weight:
272.5792
IUPAC Name:
2,3,5-trichloro-4-propylsulfinylpyridine
InChI:
InChI=1S/C8H8Cl3NOS/c1-2-3-14(13)7-5(9)4-12-8(11)6(7)10/h4H,2-3H2,1H3
InChI Key:
GVDKQZAGIOHILN-UHFFFAOYSA-N
SMILES:
CCCS(=O)c1c(Cl)cnc(c1Cl)Cl
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.939g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.568g/mol
Monoisotopic Mass:
270.939g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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