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Home > Nitro Compounds > 92033-76-6
92033-76-6 | 1-(2-(4-Nitrophenoxy)ethyl)piperidine
CAS No: 92033-76-6 Catalog No: AG003CSM MDL No:MFCD01308502
Product Description
Catalog Number:
AG003CSM
Chemical Name:
1-(2-(4-Nitrophenoxy)ethyl)piperidine
CAS Number:
92033-76-6
Molecular Formula:
C13H18N2O3
Molecular Weight:
250.2936
MDL Number:
MFCD01308502
IUPAC Name:
1-[2-(4-nitrophenoxy)ethyl]piperidine
InChI:
InChI=1S/C13H18N2O3/c16-15(17)12-4-6-13(7-5-12)18-11-10-14-8-2-1-3-9-14/h4-7H,1-3,8-11H2
InChI Key:
HLQQRQNEDYOBHS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)OCCN1CCCCC1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.298g/mol
Monoisotopic Mass:
250.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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