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178979-95-8 | 1H-Imidazole-2-methanol, 5-[(3-chlorophenyl)methyl]-1-methyl-4-(1-methylethyl)-
CAS No: 178979-95-8 Catalog No: AG0026L6 MDL No:
Product Description
Catalog Number:
AG0026L6
Chemical Name:
1H-Imidazole-2-methanol, 5-[(3-chlorophenyl)methyl]-1-methyl-4-(1-methylethyl)-
CAS Number:
178979-95-8
Molecular Formula:
C15H19ClN2O
Molecular Weight:
278.7772
IUPAC Name:
[5-[(3-chlorophenyl)methyl]-1-methyl-4-propan-2-ylimidazol-2-yl]methanol
InChI:
InChI=1S/C15H19ClN2O/c1-10(2)15-13(18(3)14(9-19)17-15)8-11-5-4-6-12(16)7-11/h4-7,10,19H,8-9H2,1-3H3
InChI Key:
IQWXUDXSXROYCG-UHFFFAOYSA-N
SMILES:
OCc1nc(c(n1C)Cc1cccc(c1)Cl)C(C)C
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.119g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.78g/mol
Monoisotopic Mass:
278.119g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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