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51036-79-4 | 2-(1H-Imidazol-2-yl)ethanol
CAS No: 51036-79-4 Catalog No: AG003ES2 MDL No:MFCD06655989
Product Description
Catalog Number:
AG003ES2
Chemical Name:
2-(1H-Imidazol-2-yl)ethanol
CAS Number:
51036-79-4
Molecular Formula:
C5H8N2O
Molecular Weight:
112.1298
MDL Number:
MFCD06655989
IUPAC Name:
2-(1H-imidazol-2-yl)ethanol
InChI:
InChI=1S/C5H8N2O/c8-4-1-5-6-2-3-7-5/h2-3,8H,1,4H2,(H,6,7)
InChI Key:
JEUPWQVILXWUFD-UHFFFAOYSA-N
SMILES:
OCCc1ncc[nH]1
Properties
Complexity:
67.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.064g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
112.132g/mol
Monoisotopic Mass:
112.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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