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88138-82-3 | Benzenamine, 4-[[6-(1H-benzimidazol-1-yl)hexyl]oxy]-
CAS No: 88138-82-3 Catalog No: AG004F2O MDL No:
Product Description
Catalog Number:
AG004F2O
Chemical Name:
Benzenamine, 4-[[6-(1H-benzimidazol-1-yl)hexyl]oxy]-
CAS Number:
88138-82-3
Molecular Formula:
C19H23N3O
Molecular Weight:
309.4054
IUPAC Name:
4-[6-(benzimidazol-1-yl)hexoxy]aniline
InChI:
InChI=1S/C19H23N3O/c20-16-9-11-17(12-10-16)23-14-6-2-1-5-13-22-15-21-18-7-3-4-8-19(18)22/h3-4,7-12,15H,1-2,5-6,13-14,20H2
InChI Key:
HWVVUEUDLLPJDH-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)OCCCCCCn1cnc2c1cccc2
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.184g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.413g/mol
Monoisotopic Mass:
309.184g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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