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Home > Nitro Compounds > 1172625-04-5
1172625-04-5 | Benzamide, 4,5-bis(2-methoxyethoxy)-2-nitro-
CAS No: 1172625-04-5 Catalog No: AG000DZU MDL No:
Product Description
Catalog Number:
AG000DZU
Chemical Name:
Benzamide, 4,5-bis(2-methoxyethoxy)-2-nitro-
CAS Number:
1172625-04-5
Molecular Formula:
C13H18N2O7
Molecular Weight:
314.2912
IUPAC Name:
4,5-bis(2-methoxyethoxy)-2-nitrobenzamide
InChI:
InChI=1S/C13H18N2O7/c1-19-3-5-21-11-7-9(13(14)16)10(15(17)18)8-12(11)22-6-4-20-2/h7-8H,3-6H2,1-2H3,(H2,14,16)
InChI Key:
WHLYYHRXEBOXGS-UHFFFAOYSA-N
SMILES:
COCCOc1cc([N+](=O)[O-])c(cc1OCCOC)C(=O)N
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.111g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.294g/mol
Monoisotopic Mass:
314.111g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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