3-Nitro-N-(3-Nitrophenyl)Benzamide
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Product Description
Product
3-Nitro-N-(3-Nitrophenyl)Benzamide
CAS
101-24-6
Formula
C13H9N3O5
Synonym
3-Nitro-N-(3-nitrophenyl)benzamide; Benzamide, 3-nitro-N-(3-nitrophenyl)-; Benzanilide, 3,3'-dinitro- (8CI); EINECS 202-927-8; NSC 9593; 3,3'-dinitrobenzanilide
Typical Product Specifications
Molecular weight
287.23
EINECS
202-927-8
SMILES
O=C(Nc1cccc([N+]([O-])=O)c1)c1cccc([N+]([O-])=O)c1
InChI
IGYJMXLXTJJVRS-UHFFFAOYSA-N
InChIKey
1S/C13H9N3O5/c17-13(9-3-1-5-11(7-9)15(18)19)14-10-4-2-6-12(8-10)16(20)21/h1-8H,(H,14,17)
Molecular weight
258.10
EINECS
202-930-4
SMILES
c1(cc(ccc1)Cl)NC(OCC#CCCl)=O
InChI
1S/C11H9Cl2NO2/c12-6-1-2-7-16-11(15)14-10-5-3-4-9(13)8-10/h3-5,8H,6-7H2,(H,14,15)
InChIKey
MCOQHIWZJUDQIC-UHFFFAOYSA-N
Boiling Point
224 dec ° C
Atmospheric OH Rate Constant
5.54E-11 cm3/molecule-sec
Henry's Law Constant
1.17E-08 atm-m3/mole
Vapor Pressure
3.80E-07 mm Hg
Melting Point
75 ° C
log P (octanol-water)
3.410
Water solubility
11 mg/L
Class
Industry
3-Nitro-N-(3-Nitrophenyl)Benzamide
Product Description
Product
3-Nitro-N-(3-Nitrophenyl)Benzamide
CAS
101-24-6
Formula
C13H9N3O5
Synonym
3-Nitro-N-(3-nitrophenyl)benzamide; Benzamide, 3-nitro-N-(3-nitrophenyl)-; Benzanilide, 3,3'-dinitro- (8CI); EINECS 202-927-8; NSC 9593; 3,3'-dinitrobenzanilide
Typical Product Specifications
Molecular weight
287.23
EINECS
202-927-8
SMILES
O=C(Nc1cccc([N+]([O-])=O)c1)c1cccc([N+]([O-])=O)c1
InChI
IGYJMXLXTJJVRS-UHFFFAOYSA-N
InChIKey
1S/C13H9N3O5/c17-13(9-3-1-5-11(7-9)15(18)19)14-10-4-2-6-12(8-10)16(20)21/h1-8H,(H,14,17)
Molecular weight
258.10
EINECS
202-930-4
SMILES
c1(cc(ccc1)Cl)NC(OCC#CCCl)=O
InChI
1S/C11H9Cl2NO2/c12-6-1-2-7-16-11(15)14-10-5-3-4-9(13)8-10/h3-5,8H,6-7H2,(H,14,15)
InChIKey
MCOQHIWZJUDQIC-UHFFFAOYSA-N
Boiling Point
224 dec ° C
Atmospheric OH Rate Constant
5.54E-11 cm3/molecule-sec
Henry's Law Constant
1.17E-08 atm-m3/mole
Vapor Pressure
3.80E-07 mm Hg
Melting Point
75 ° C
log P (octanol-water)
3.410
Water solubility
11 mg/L
Class
Industry
