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Home > Nitro Compounds > 400086-98-8
400086-98-8 | ethyl N-methoxy-N-(3-nitropyridin-2-yl)carbamate
CAS No: 400086-98-8 Catalog No: AG00IYPC MDL No:MFCD02571834
Product Description
Catalog Number:
AG00IYPC
Chemical Name:
ethyl N-methoxy-N-(3-nitropyridin-2-yl)carbamate
CAS Number:
400086-98-8
Molecular Formula:
C9H11N3O5
Molecular Weight:
241.2007
MDL Number:
MFCD02571834
IUPAC Name:
ethyl N-methoxy-N-(3-nitropyridin-2-yl)carbamate
InChI:
InChI=1S/C9H11N3O5/c1-3-17-9(13)11(16-2)8-7(12(14)15)5-4-6-10-8/h4-6H,3H2,1-2H3
InChI Key:
AXXRTTIYFUDZNY-UHFFFAOYSA-N
SMILES:
CCOC(=O)N(c1ncccc1[N+](=O)[O-])OC
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.07g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.203g/mol
Monoisotopic Mass:
241.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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