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26482-10-0

26482-10-0 | 1H-Imidazole-2-butanol, 5-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-

CAS No: 26482-10-0 Catalog No: AG002TE9 MDL No:

Product Description

Catalog Number:
AG002TE9
Chemical Name:
1H-Imidazole-2-butanol, 5-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-
CAS Number:
26482-10-0
Molecular Formula:
C18H26N2O3
Molecular Weight:
318.4106
IUPAC Name:
4-[4-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-1H-imidazol-2-yl]butan-1-ol
InChI:
InChI=1S/C18H26N2O3/c1-13-15(20-18(19-13)6-4-5-11-21)9-7-14-8-10-16(22-2)17(12-14)23-3/h8,10,12,21H,4-7,9,11H2,1-3H3,(H,19,20)
InChI Key:
RKGSIHJYOCYEOU-UHFFFAOYSA-N
SMILES:
OCCCCc1nc(c([nH]1)CCc1ccc(c(c1)OC)OC)C
NSC Number:
142209

Properties

Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.194g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
318.417g/mol
Monoisotopic Mass:
318.194g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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