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148428-80-2 | Benzoyl chloride, 2,5-dichloro-4-nitro-
CAS No: 148428-80-2 Catalog No: AG01FCFP MDL No:
Product Description
Catalog Number:
AG01FCFP
Chemical Name:
Benzoyl chloride, 2,5-dichloro-4-nitro-
CAS Number:
148428-80-2
Molecular Formula:
C7H2Cl3NO3
Molecular Weight:
254.4547
IUPAC Name:
2,5-dichloro-4-nitrobenzoyl chloride
InChI:
InChI=1S/C7H2Cl3NO3/c8-4-2-6(11(13)14)5(9)1-3(4)7(10)12/h1-2H
InChI Key:
FINNQRYZVDJBRN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Cl)c(cc1Cl)C(=O)Cl
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.91g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.447g/mol
Monoisotopic Mass:
252.91g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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