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Home > Imidazoles > 180307-01-1
180307-01-1 | 1H-Imidazole-5-ethanol, hydrochloride (1:1)
CAS No: 180307-01-1 Catalog No: AG0021WT MDL No:MFCD27665423
Product Description
Catalog Number:
AG0021WT
Chemical Name:
1H-Imidazole-5-ethanol, hydrochloride (1:1)
CAS Number:
180307-01-1
Molecular Formula:
C5H9ClN2O
Molecular Weight:
148.5908
MDL Number:
MFCD27665423
IUPAC Name:
2-(1H-imidazol-5-yl)ethanol;hydrochloride
InChI:
InChI=1S/C5H8N2O.ClH/c8-2-1-5-3-6-4-7-5;/h3-4,8H,1-2H2,(H,6,7);1H
InChI Key:
XCBCBMPKJBWMMI-UHFFFAOYSA-N
SMILES:
OCCc1cnc[nH]1.Cl
Properties
Complexity:
67.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.04g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
148.59g/mol
Monoisotopic Mass:
148.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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