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225112-09-4 | 4-(2-Chloro-5-thienyl)-4-hydroxy-1-methylpiperidine
CAS No: 225112-09-4 Catalog No: AG01F8VH MDL No:
Product Description
Catalog Number:
AG01F8VH
Chemical Name:
4-(2-Chloro-5-thienyl)-4-hydroxy-1-methylpiperidine
CAS Number:
225112-09-4
Molecular Formula:
C10H14ClNOS
Molecular Weight:
231.7423
IUPAC Name:
4-(5-chlorothiophen-2-yl)-1-methylpiperidin-4-ol
InChI:
InChI=1S/C10H14ClNOS/c1-12-6-4-10(13,5-7-12)8-2-3-9(11)14-8/h2-3,13H,4-7H2,1H3
InChI Key:
FLHHORVUWJQDQV-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)(O)c1ccc(s1)Cl
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.738g/mol
Monoisotopic Mass:
231.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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