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Home > Nitro Compounds > 478248-47-4
478248-47-4 | N-(2,4-dichlorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
CAS No: 478248-47-4 Catalog No: AG00IRG0 MDL No:MFCD02082948
Product Description
Catalog Number:
AG00IRG0
Chemical Name:
N-(2,4-dichlorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
CAS Number:
478248-47-4
Molecular Formula:
C15H8Cl2N2O3S
Molecular Weight:
367.2066
MDL Number:
MFCD02082948
IUPAC Name:
N-(2,4-dichlorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
InChI:
InChI=1S/C15H8Cl2N2O3S/c16-9-1-3-12(11(17)7-9)18-15(20)14-6-8-5-10(19(21)22)2-4-13(8)23-14/h1-7H,(H,18,20)
InChI Key:
YPLKXHWRWUPTGY-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)NC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.963g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
367.2g/mol
Monoisotopic Mass:
365.963g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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