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91430-23-8 | 2-nitro-N-pentylaniline
CAS No: 91430-23-8 Catalog No: AG01AXJ0 MDL No:MFCD11125270
Product Description
Catalog Number:
AG01AXJ0
Chemical Name:
2-nitro-N-pentylaniline
CAS Number:
91430-23-8
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
MDL Number:
MFCD11125270
IUPAC Name:
2-nitro-N-pentylaniline
InChI:
InChI=1S/C11H16N2O2/c1-2-3-6-9-12-10-7-4-5-8-11(10)13(14)15/h4-5,7-8,12H,2-3,6,9H2,1H3
InChI Key:
ZDBRHTYGQVFIEY-UHFFFAOYSA-N
SMILES:
CCCCCNc1ccccc1[N+](=O)[O-]
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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