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Home > Nitro Compounds > 133339-10-3
133339-10-3 | 4-(3,5-Dinitrobenzoyl)morpholine
CAS No: 133339-10-3 Catalog No: AG00HSVT MDL No:MFCD00426660
Product Description
Catalog Number:
AG00HSVT
Chemical Name:
4-(3,5-Dinitrobenzoyl)morpholine
CAS Number:
133339-10-3
Molecular Formula:
C11H11N3O6
Molecular Weight:
281.2215
MDL Number:
MFCD00426660
IUPAC Name:
(3,5-dinitrophenyl)-morpholin-4-ylmethanone
InChI:
InChI=1S/C11H11N3O6/c15-11(12-1-3-20-4-2-12)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,1-4H2
InChI Key:
KKSXPSGNMCINHN-UHFFFAOYSA-N
SMILES:
O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])N1CCOCC1
NSC Number:
519079
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.065g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.224g/mol
Monoisotopic Mass:
281.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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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