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Home > Nitro Compounds > 917909-46-7
917909-46-7 | Benzamide, 3-ethoxy-4-nitro-
CAS No: 917909-46-7 Catalog No: AG00IGVR MDL No:MFCD16658740
Product Description
Catalog Number:
AG00IGVR
Chemical Name:
Benzamide, 3-ethoxy-4-nitro-
CAS Number:
917909-46-7
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
MDL Number:
MFCD16658740
IUPAC Name:
3-ethoxy-4-nitrobenzamide
InChI:
InChI=1S/C9H10N2O4/c1-2-15-8-5-6(9(10)12)3-4-7(8)11(13)14/h3-5H,2H2,1H3,(H2,10,12)
InChI Key:
GIMLDSWLSOWBOA-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1[N+](=O)[O-])C(=O)N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.189g/mol
Monoisotopic Mass:
210.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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