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14194-13-9 | Benzenamine, 4-nitro-N-(1-piperidinylmethylene)-
CAS No: 14194-13-9 Catalog No: AG001HFD MDL No:
Product Description
Catalog Number:
AG001HFD
Chemical Name:
Benzenamine, 4-nitro-N-(1-piperidinylmethylene)-
CAS Number:
14194-13-9
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
IUPAC Name:
N-(4-nitrophenyl)-1-piperidin-1-ylmethanimine
InChI:
InChI=1S/C12H15N3O2/c16-15(17)12-6-4-11(5-7-12)13-10-14-8-2-1-3-9-14/h4-7,10H,1-3,8-9H2
InChI Key:
IMKBTFOHBYTFCZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)N=CN1CCCCC1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.271g/mol
Monoisotopic Mass:
233.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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