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29743-09-7 | Benzenamine, N-[(4-butoxyphenyl)methylene]-4-butyl-
CAS No: 29743-09-7 Catalog No: AG002ZAH MDL No:
Product Description
Catalog Number:
AG002ZAH
Chemical Name:
Benzenamine, N-[(4-butoxyphenyl)methylene]-4-butyl-
CAS Number:
29743-09-7
Molecular Formula:
C21H27NO
Molecular Weight:
309.4452
IUPAC Name:
1-(4-butoxyphenyl)-N-(4-butylphenyl)methanimine
InChI:
InChI=1S/C21H27NO/c1-3-5-7-18-8-12-20(13-9-18)22-17-19-10-14-21(15-11-19)23-16-6-4-2/h8-15,17H,3-7,16H2,1-2H3
InChI Key:
OAGDRAPRLSSSQT-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C=Nc1ccc(cc1)CCCC
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.209g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.453g/mol
Monoisotopic Mass:
309.209g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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