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84865-93-0 | Benzenamine, 3-chloro-4-(4-propoxyphenoxy)-
CAS No: 84865-93-0 Catalog No: AG004MM2 MDL No:
Product Description
Catalog Number:
AG004MM2
Chemical Name:
Benzenamine, 3-chloro-4-(4-propoxyphenoxy)-
CAS Number:
84865-93-0
Molecular Formula:
C15H16ClNO2
Molecular Weight:
277.7460
IUPAC Name:
3-chloro-4-(4-propoxyphenoxy)aniline
InChI:
InChI=1S/C15H16ClNO2/c1-2-9-18-12-4-6-13(7-5-12)19-15-8-3-11(17)10-14(15)16/h3-8,10H,2,9,17H2,1H3
InChI Key:
NWIXIMXWVMLCRO-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)Oc1ccc(cc1Cl)N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.087g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.748g/mol
Monoisotopic Mass:
277.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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