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Home > Nitro Compounds > 866157-49-5
866157-49-5 | 2,6-dimethyl-4-(4-methyl-2,6-dinitrophenyl)morpholine
CAS No: 866157-49-5 Catalog No: AG00IZVG MDL No:MFCD05670001
Product Description
Catalog Number:
AG00IZVG
Chemical Name:
2,6-dimethyl-4-(4-methyl-2,6-dinitrophenyl)morpholine
CAS Number:
866157-49-5
Molecular Formula:
C13H17N3O5
Molecular Weight:
295.2912
MDL Number:
MFCD05670001
IUPAC Name:
2,6-dimethyl-4-(4-methyl-2,6-dinitrophenyl)morpholine
InChI:
InChI=1S/C13H17N3O5/c1-8-4-11(15(17)18)13(12(5-8)16(19)20)14-6-9(2)21-10(3)7-14/h4-5,9-10H,6-7H2,1-3H3
InChI Key:
NNDMGZJKWCOVPF-UHFFFAOYSA-N
SMILES:
CC1OC(C)CN(C1)c1c(cc(cc1[N+](=O)[O-])C)[N+](=O)[O-]
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.117g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.295g/mol
Monoisotopic Mass:
295.117g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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