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Home > Fluorides > 140235-26-3
140235-26-3 | Methanone, (3,4-difluorophenyl)-4-piperidinyl-, hydrochloride (1:1)
CAS No: 140235-26-3 Catalog No: AG001C6U MDL No:
Product Description
Catalog Number:
AG001C6U
Chemical Name:
Methanone, (3,4-difluorophenyl)-4-piperidinyl-, hydrochloride (1:1)
CAS Number:
140235-26-3
Molecular Formula:
C12H14ClF2NO
Molecular Weight:
261.6955
IUPAC Name:
(3,4-difluorophenyl)-piperidin-4-ylmethanone;hydrochloride
InChI:
InChI=1S/C12H13F2NO.ClH/c13-10-2-1-9(7-11(10)14)12(16)8-3-5-15-6-4-8;/h1-2,7-8,15H,3-6H2;1H
InChI Key:
IPNJNEPAHFKDLB-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)F)F)C1CCNCC1.Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.073g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.697g/mol
Monoisotopic Mass:
261.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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