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Home > Nitro Compounds > 1426290-64-3
1426290-64-3 | 4-[(4-NITROBENZYL)OXY]PIPERIDINE HYDROCHLORIDE
CAS No: 1426290-64-3 Catalog No: AG01AQUJ MDL No:MFCD16661093
Product Description
Catalog Number:
AG01AQUJ
Chemical Name:
4-[(4-NITROBENZYL)OXY]PIPERIDINE HYDROCHLORIDE
CAS Number:
1426290-64-3
Molecular Formula:
C12H17ClN2O3
Molecular Weight:
272.7280
MDL Number:
MFCD16661093
IUPAC Name:
4-[(4-nitrophenyl)methoxy]piperidine;hydrochloride
InChI:
InChI=1S/C12H16N2O3.ClH/c15-14(16)11-3-1-10(2-4-11)9-17-12-5-7-13-8-6-12;/h1-4,12-13H,5-9H2;1H
InChI Key:
XGJTVQQTZKCYHE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)COC1CCNCC1.Cl
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.729g/mol
Monoisotopic Mass:
272.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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