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2750-81-4 | Naphthalene, 1,4-dichloro-5-nitro-
CAS No: 2750-81-4 Catalog No: AG002TY4 MDL No:
Product Description
Catalog Number:
AG002TY4
Chemical Name:
Naphthalene, 1,4-dichloro-5-nitro-
CAS Number:
2750-81-4
Molecular Formula:
C10H5Cl2NO2
Molecular Weight:
242.0582
IUPAC Name:
1,4-dichloro-5-nitronaphthalene
InChI:
InChI=1S/C10H5Cl2NO2/c11-7-4-5-8(12)10-6(7)2-1-3-9(10)13(14)15/h1-5H
InChI Key:
UFYHMOUUBQRTOS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1c(Cl)ccc2Cl
EC Number:
220-391-3
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.97g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.055g/mol
Monoisotopic Mass:
240.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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