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Home > Imidazoles > 2031242-52-9
2031242-52-9 | rac-[(2R,3S)-2-(1-methyl-1H-imidazol-2-yl)oxolan-3-yl]methanol, trans
CAS No: 2031242-52-9 Catalog No: AG01B745 MDL No:MFCD30347911
Product Description
Catalog Number:
AG01B745
Chemical Name:
rac-[(2R,3S)-2-(1-methyl-1H-imidazol-2-yl)oxolan-3-yl]methanol, trans
CAS Number:
2031242-52-9
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
MDL Number:
MFCD30347911
IUPAC Name:
[(2R,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanol
InChI:
InChI=1S/C9H14N2O2/c1-11-4-3-10-9(11)8-7(6-12)2-5-13-8/h3-4,7-8,12H,2,5-6H2,1H3/t7-,8+/m0/s1
InChI Key:
MMDGBGMWWLPAEI-JGVFFNPUSA-N
SMILES:
OC[C@@H]1CCO[C@H]1c1nccn1C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
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:
2
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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