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101259-33-0 | Ethanol, 2-[(2,6-dichloro-4-nitrophenyl)amino]-
CAS No: 101259-33-0 Catalog No: AG00042X MDL No:
Product Description
Catalog Number:
AG00042X
Chemical Name:
Ethanol, 2-[(2,6-dichloro-4-nitrophenyl)amino]-
CAS Number:
101259-33-0
Molecular Formula:
C8H8Cl2N2O3
Molecular Weight:
251.0667
IUPAC Name:
2-(2,6-dichloro-4-nitroanilino)ethanol
InChI:
InChI=1S/C8H8Cl2N2O3/c9-6-3-5(12(14)15)4-7(10)8(6)11-1-2-13/h3-4,11,13H,1-2H2
InChI Key:
ZTSBATNICSVYPP-UHFFFAOYSA-N
SMILES:
OCCNc1c(Cl)cc(cc1Cl)[N+](=O)[O-]
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.991g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.063g/mol
Monoisotopic Mass:
249.991g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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