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183281-07-4 | Benzoyl chloride, 4-(3,4-dichloro-2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-
CAS No: 183281-07-4 Catalog No: AG0027GM MDL No:
Product Description
Catalog Number:
AG0027GM
Chemical Name:
Benzoyl chloride, 4-(3,4-dichloro-2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-
CAS Number:
183281-07-4
Molecular Formula:
C11H4Cl3NO3
Molecular Weight:
304.5134
IUPAC Name:
4-(3,4-dichloro-2,5-dioxopyrrol-1-yl)benzoyl chloride
InChI:
InChI=1S/C11H4Cl3NO3/c12-7-8(13)11(18)15(10(7)17)6-3-1-5(2-4-6)9(14)16/h1-4H
InChI Key:
OLKCGPLSPVMXAT-UHFFFAOYSA-N
SMILES:
O=C1N(c2ccc(cc2)C(=O)Cl)C(=O)C(=C1Cl)Cl
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.926g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.507g/mol
Monoisotopic Mass:
302.926g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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