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Home > Nitro Compounds > 300375-20-6
300375-20-6 | N-[4-(morpholin-4-yl)phenyl]-2,4-dinitroaniline
CAS No: 300375-20-6 Catalog No: AG00IZSF MDL No:MFCD00540015
Product Description
Catalog Number:
AG00IZSF
Chemical Name:
N-[4-(morpholin-4-yl)phenyl]-2,4-dinitroaniline
CAS Number:
300375-20-6
Molecular Formula:
C16H16N4O5
Molecular Weight:
344.3220
MDL Number:
MFCD00540015
IUPAC Name:
N-(4-morpholin-4-ylphenyl)-2,4-dinitroaniline
InChI:
InChI=1S/C16H16N4O5/c21-19(22)14-5-6-15(16(11-14)20(23)24)17-12-1-3-13(4-2-12)18-7-9-25-10-8-18/h1-6,11,17H,7-10H2
InChI Key:
XHWCPEPMJFTJTQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Nc1ccc(cc1)N1CCOCC1)[N+](=O)[O-]
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.112g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.327g/mol
Monoisotopic Mass:
344.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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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