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88073-52-3 | Piperidine, 1-(3-chloro-2-methylpropyl)-, hydrochloride
CAS No: 88073-52-3 Catalog No: AG004ETE MDL No:
Product Description
Catalog Number:
AG004ETE
Chemical Name:
Piperidine, 1-(3-chloro-2-methylpropyl)-, hydrochloride
CAS Number:
88073-52-3
Molecular Formula:
C9H19Cl2N
Molecular Weight:
212.1599
IUPAC Name:
1-(3-chloro-2-methylpropyl)piperidine;hydrochloride
InChI:
InChI=1S/C9H18ClN.ClH/c1-9(7-10)8-11-5-3-2-4-6-11;/h9H,2-8H2,1H3;1H
InChI Key:
NNTKQMXQGBUYAD-UHFFFAOYSA-N
SMILES:
ClCC(CN1CCCCC1)C.Cl
Properties
Complexity:
99.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.158g/mol
Monoisotopic Mass:
211.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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