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Home > Nitro Compounds > 100377-77-3
100377-77-3 | 4-ETHYL-3-NITROBENZENESULFONAMIDE
CAS No: 100377-77-3 Catalog No: AG01B2VL MDL No:MFCD07626334
Product Description
Catalog Number:
AG01B2VL
Chemical Name:
4-ETHYL-3-NITROBENZENESULFONAMIDE
CAS Number:
100377-77-3
Molecular Formula:
C8H10N2O4S
Molecular Weight:
230.2410
MDL Number:
MFCD07626334
IUPAC Name:
4-ethyl-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C8H10N2O4S/c1-2-6-3-4-7(15(9,13)14)5-8(6)10(11)12/h3-5H,2H2,1H3,(H2,9,13,14)
InChI Key:
MWDFYPDSWMARNT-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1[N+](=O)[O-])S(=O)(=O)N
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.036g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.238g/mol
Monoisotopic Mass:
230.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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