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101991-76-8 | 1-Propanone, 2-(2,4-dichlorophenoxy)-1-(1-piperidinyl)-
CAS No: 101991-76-8 Catalog No: AG00066F MDL No:MFCD01339369
Product Description
Catalog Number:
AG00066F
Chemical Name:
1-Propanone, 2-(2,4-dichlorophenoxy)-1-(1-piperidinyl)-
CAS Number:
101991-76-8
Molecular Formula:
C14H17Cl2NO2
Molecular Weight:
302.1963
MDL Number:
MFCD01339369
IUPAC Name:
2-(2,4-dichlorophenoxy)-1-piperidin-1-ylpropan-1-one
InChI:
InChI=1S/C14H17Cl2NO2/c1-10(14(18)17-7-3-2-4-8-17)19-13-6-5-11(15)9-12(13)16/h5-6,9-10H,2-4,7-8H2,1H3
InChI Key:
KQSVEWNCWPLKQV-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)OC(C(=O)N1CCCCC1)C
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.064g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.195g/mol
Monoisotopic Mass:
301.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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