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1220033-07-7 | 4-(2,4-Dichloro-benzyloxy)-piperidine hydrochloride
CAS No: 1220033-07-7 Catalog No: AG01F8P9 MDL No:
Product Description
Catalog Number:
AG01F8P9
Chemical Name:
4-(2,4-Dichloro-benzyloxy)-piperidine hydrochloride
CAS Number:
1220033-07-7
Molecular Formula:
C12H16Cl3NO
Molecular Weight:
296.6205
IUPAC Name:
4-[(2,4-dichlorophenyl)methoxy]piperidine;hydrochloride
InChI:
InChI=1S/C12H15Cl2NO.ClH/c13-10-2-1-9(12(14)7-10)8-16-11-3-5-15-6-4-11;/h1-2,7,11,15H,3-6,8H2;1H
InChI Key:
UJNFVKXHPQOUMR-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)COC1CCNCC1.Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.03g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.616g/mol
Monoisotopic Mass:
295.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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