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1079178-12-3 | 3-methoxy-2-(4-methylimidazol-1-yl)-5-nitropyridine
CAS No: 1079178-12-3 Catalog No: AG00HB1T MDL No:MFCD11870553
Product Description
Catalog Number:
AG00HB1T
Chemical Name:
3-methoxy-2-(4-methylimidazol-1-yl)-5-nitropyridine
CAS Number:
1079178-12-3
Molecular Formula:
C10H10N4O3
Molecular Weight:
234.2114
MDL Number:
MFCD11870553
IUPAC Name:
3-methoxy-2-(4-methylimidazol-1-yl)-5-nitropyridine
InChI:
InChI=1S/C10H10N4O3/c1-7-5-13(6-12-7)10-9(17-2)3-8(4-11-10)14(15)16/h3-6H,1-2H3
InChI Key:
BPSDNCLLKWZSEC-UHFFFAOYSA-N
SMILES:
COc1cc(cnc1n1cnc(c1)C)[N+](=O)[O-]
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.215g/mol
Monoisotopic Mass:
234.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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