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Home > Nitro Compounds > 30058-27-6
30058-27-6 | 2-methoxy-4-morpholino-5-nitrophenyl methyl ether
CAS No: 30058-27-6 Catalog No: AG00J7EQ MDL No:MFCD09754328
Product Description
Catalog Number:
AG00J7EQ
Chemical Name:
2-methoxy-4-morpholino-5-nitrophenyl methyl ether
CAS Number:
30058-27-6
Molecular Formula:
C12H16N2O5
Molecular Weight:
268.2658
MDL Number:
MFCD09754328
IUPAC Name:
4-(4,5-dimethoxy-2-nitrophenyl)morpholine
InChI:
InChI=1S/C12H16N2O5/c1-17-11-7-9(13-3-5-19-6-4-13)10(14(15)16)8-12(11)18-2/h7-8H,3-6H2,1-2H3
InChI Key:
WPVPJTLULWULMF-UHFFFAOYSA-N
SMILES:
COc1cc(N2CCOCC2)c(cc1OC)[N+](=O)[O-]
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.269g/mol
Monoisotopic Mass:
268.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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