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1822-61-3 | Piperidine, 4-(chloromethyl)-, hydrochloride (1:1)
CAS No: 1822-61-3 Catalog No: AG0023H9 MDL No:MFCD11110948
Product Description
Catalog Number:
AG0023H9
Chemical Name:
Piperidine, 4-(chloromethyl)-, hydrochloride (1:1)
CAS Number:
1822-61-3
Molecular Formula:
C6H13Cl2N
Molecular Weight:
170.0801
MDL Number:
MFCD11110948
IUPAC Name:
4-(chloromethyl)piperidine;hydrochloride
InChI:
InChI=1S/C6H12ClN.ClH/c7-5-6-1-3-8-4-2-6;/h6,8H,1-5H2;1H
InChI Key:
XLHLVPVJPDGPBC-UHFFFAOYSA-N
SMILES:
ClCC1CCNCC1.Cl
NSC Number:
251636
Properties
Complexity:
59.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.077g/mol
Monoisotopic Mass:
169.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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