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83054-68-6 | Benzenamine, 4-[(4-chloro-1-naphthalenyl)oxy]-3-methoxy-
CAS No: 83054-68-6 Catalog No: AG004X4S MDL No:
Product Description
Catalog Number:
AG004X4S
Chemical Name:
Benzenamine, 4-[(4-chloro-1-naphthalenyl)oxy]-3-methoxy-
CAS Number:
83054-68-6
Molecular Formula:
C17H14ClNO2
Molecular Weight:
299.7516
IUPAC Name:
4-(4-chloronaphthalen-1-yl)oxy-3-methoxyaniline
InChI:
InChI=1S/C17H14ClNO2/c1-20-17-10-11(19)6-8-16(17)21-15-9-7-14(18)12-4-2-3-5-13(12)15/h2-10H,19H2,1H3
InChI Key:
DUPMDURJVIQSAR-UHFFFAOYSA-N
SMILES:
COc1cc(N)ccc1Oc1ccc(c2c1cccc2)Cl
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.071g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.754g/mol
Monoisotopic Mass:
299.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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