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Home > Imidazoles > 1461706-51-3
1461706-51-3 | 2-(1-methyl-1H-imidazol-5-yl)oxan-4-ol
CAS No: 1461706-51-3 Catalog No: AG01ABQJ MDL No:MFCD21699577
Product Description
Catalog Number:
AG01ABQJ
Chemical Name:
2-(1-methyl-1H-imidazol-5-yl)oxan-4-ol
CAS Number:
1461706-51-3
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
MDL Number:
MFCD21699577
IUPAC Name:
2-(3-methylimidazol-4-yl)oxan-4-ol
InChI:
InChI=1S/C9H14N2O2/c1-11-6-10-5-8(11)9-4-7(12)2-3-13-9/h5-7,9,12H,2-4H2,1H3
InChI Key:
OALXTSYQNAVAQQ-UHFFFAOYSA-N
SMILES:
Cn1cncc1C1CC(O)CCO1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.223g/mol
Monoisotopic Mass:
182.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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