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Home > Nitro Compounds > 84946-14-5
84946-14-5 | Benzamide, N-(2-hydroxyethyl)-2-nitro-
CAS No: 84946-14-5 Catalog No: AG005308 MDL No:
Product Description
Catalog Number:
AG005308
Chemical Name:
Benzamide, N-(2-hydroxyethyl)-2-nitro-
CAS Number:
84946-14-5
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
IUPAC Name:
N-(2-hydroxyethyl)-2-nitrobenzamide
InChI:
InChI=1S/C9H10N2O4/c12-6-5-10-9(13)7-3-1-2-4-8(7)11(14)15/h1-4,12H,5-6H2,(H,10,13)
InChI Key:
DDHRZXUHAFEJIO-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1ccccc1[N+](=O)[O-]
EC Number:
284-617-2
Properties
Complexity:
239
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:
2
Isotope Atom Count:
0
Molecular Weight:
210.189g/mol
Monoisotopic Mass:
210.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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