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13167-25-4 | 1H-Pyrrole-2,5-dione, 1-(2,4,6-trichlorophenyl)-
CAS No: 13167-25-4 Catalog No: AG000ZKH MDL No:MFCD06797173
Product Description
Catalog Number:
AG000ZKH
Chemical Name:
1H-Pyrrole-2,5-dione, 1-(2,4,6-trichlorophenyl)-
CAS Number:
13167-25-4
Molecular Formula:
C10H4Cl3NO2
Molecular Weight:
276.5033
MDL Number:
MFCD06797173
IUPAC Name:
1-(2,4,6-trichlorophenyl)pyrrole-2,5-dione
InChI:
InChI=1S/C10H4Cl3NO2/c11-5-3-6(12)10(7(13)4-5)14-8(15)1-2-9(14)16/h1-4H
InChI Key:
VHZJMAJCUAWIHV-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(c(c1)Cl)N1C(=O)C=CC1=O
EC Number:
236-108-1
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.931g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.497g/mol
Monoisotopic Mass:
274.931g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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