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Home > Nitro Compounds > 547707-22-2
547707-22-2 | N-(2-methoxy-4-nitrophenyl)tetrahydrofuran-2-carboxamide
CAS No: 547707-22-2 Catalog No: AG00JGRA MDL No:MFCD03398071
Product Description
Catalog Number:
AG00JGRA
Chemical Name:
N-(2-methoxy-4-nitrophenyl)tetrahydrofuran-2-carboxamide
CAS Number:
547707-22-2
Molecular Formula:
C12H14N2O5
Molecular Weight:
266.2500
MDL Number:
MFCD03398071
IUPAC Name:
N-(2-methoxy-4-nitrophenyl)oxolane-2-carboxamide
InChI:
InChI=1S/C12H14N2O5/c1-18-11-7-8(14(16)17)4-5-9(11)13-12(15)10-3-2-6-19-10/h4-5,7,10H,2-3,6H2,1H3,(H,13,15)
InChI Key:
IQRCPMXQFQPCRA-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1NC(=O)C1CCCO1)[N+](=O)[O-]
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.253g/mol
Monoisotopic Mass:
266.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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