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16824-48-9 | Benzenamine, 5-chloro-2-(4-methylphenoxy)-
CAS No: 16824-48-9 Catalog No: AG001XXZ MDL No:MFCD00086557
Product Description
Catalog Number:
AG001XXZ
Chemical Name:
Benzenamine, 5-chloro-2-(4-methylphenoxy)-
CAS Number:
16824-48-9
Molecular Formula:
C13H12ClNO
Molecular Weight:
233.6935
MDL Number:
MFCD00086557
IUPAC Name:
5-chloro-2-(4-methylphenoxy)aniline;hydrochloride
InChI:
InChI=1S/C13H12ClNO.ClH/c1-9-2-5-11(6-3-9)16-13-7-4-10(14)8-12(13)15;/h2-8H,15H2,1H3;1H
InChI Key:
NZYJJECYGIOGOH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Oc1ccc(cc1N)Cl
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.153g/mol
Monoisotopic Mass:
269.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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