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1458-63-5 | Piperidine, 1-(3-chloropropyl)-
CAS No: 1458-63-5 Catalog No: AG001DFE MDL No:MFCD00044515
Product Description
Catalog Number:
AG001DFE
Chemical Name:
Piperidine, 1-(3-chloropropyl)-
CAS Number:
1458-63-5
Molecular Formula:
C8H16ClN
Molecular Weight:
161.6723
MDL Number:
MFCD00044515
IUPAC Name:
1-(3-chloropropyl)piperidine
InChI:
InChI=1S/C8H16ClN/c9-5-4-8-10-6-2-1-3-7-10/h1-8H2
InChI Key:
HDDNBUNZJIQDBQ-UHFFFAOYSA-N
SMILES:
ClCCCN1CCCCC1
Properties
Complexity:
79.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.097g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.673g/mol
Monoisotopic Mass:
161.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Novel chalcone-based fluorescent human histamine h(3) receptor ligands as pharmacological tools. | Frontiers in systems neuroscience 20120101 |
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