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114881-18-4 | Benzenamine, N-[[4-(heptyloxy)phenyl]methylene]-4-hexyl-, [N(E)]-
CAS No: 114881-18-4 Catalog No: AG000FEQ MDL No:
Product Description
Catalog Number:
AG000FEQ
Chemical Name:
Benzenamine, N-[[4-(heptyloxy)phenyl]methylene]-4-hexyl-, [N(E)]-
CAS Number:
114881-18-4
Molecular Formula:
C26H37NO
Molecular Weight:
379.5781
IUPAC Name:
1-(4-heptoxyphenyl)-N-(4-hexylphenyl)methanimine
InChI:
InChI=1S/C26H37NO/c1-3-5-7-9-11-21-28-26-19-15-24(16-20-26)22-27-25-17-13-23(14-18-25)12-10-8-6-4-2/h13-20,22H,3-12,21H2,1-2H3
InChI Key:
DHZNBIFRYLTMHQ-UHFFFAOYSA-N
SMILES:
CCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)CCCCCC
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.288g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.588g/mol
Monoisotopic Mass:
379.288g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
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