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87477-65-4 | Benzenamine, 4-[[10-(1H-imidazol-1-yl)decyl]oxy]-
CAS No: 87477-65-4 Catalog No: AG004FN5 MDL No:
Product Description
Catalog Number:
AG004FN5
Chemical Name:
Benzenamine, 4-[[10-(1H-imidazol-1-yl)decyl]oxy]-
CAS Number:
87477-65-4
Molecular Formula:
C19H29N3O
Molecular Weight:
315.4531
IUPAC Name:
4-(10-imidazol-1-yldecoxy)aniline
InChI:
InChI=1S/C19H29N3O/c20-18-9-11-19(12-10-18)23-16-8-6-4-2-1-3-5-7-14-22-15-13-21-17-22/h9-13,15,17H,1-8,14,16,20H2
InChI Key:
XIEIGUBATHQRAQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)OCCCCCCCCCCn1cncc1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.231g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.461g/mol
Monoisotopic Mass:
315.231g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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