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Home > Nitro Compounds > 125043-83-6
125043-83-6 | Piperidine, 4-(3-nitrophenoxy)-, hydrochloride (1:1)
CAS No: 125043-83-6 Catalog No: AG000N12 MDL No:MFCD09998996
Product Description
Catalog Number:
AG000N12
Chemical Name:
Piperidine, 4-(3-nitrophenoxy)-, hydrochloride (1:1)
CAS Number:
125043-83-6
Molecular Formula:
C11H15ClN2O3
Molecular Weight:
258.7014
MDL Number:
MFCD09998996
IUPAC Name:
4-(3-nitrophenoxy)piperidine;hydrochloride
InChI:
InChI=1S/C11H14N2O3.ClH/c14-13(15)9-2-1-3-11(8-9)16-10-4-6-12-7-5-10;/h1-3,8,10,12H,4-7H2;1H
InChI Key:
QZNVAZLSQUKSQN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)OC1CCNCC1.Cl
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.077g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.702g/mol
Monoisotopic Mass:
258.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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