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Home > Nitro Compounds > 726-17-0
726-17-0 | 4-(4-Nitrobenzyl)aniline
CAS No: 726-17-0 Catalog No: AG00FTLP MDL No:
Product Description
Catalog Number:
AG00FTLP
Chemical Name:
4-(4-Nitrobenzyl)aniline
CAS Number:
726-17-0
IUPAC Name:
4-[(4-nitrophenyl)methyl]aniline
InChI:
InChI=1S/C13H12N2O2/c14-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)15(16)17/h1-8H,9,14H2
InChI Key:
XTAVQWSBKJAURD-UHFFFAOYSA-N
NSC Number:
86679
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.251g/mol
Monoisotopic Mass:
228.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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