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Home > Imidazoles > 85610-16-8
85610-16-8 | (2-methyl-1H-imidazole-4,5-diyl)dimethanol
CAS No: 85610-16-8 Catalog No: AG00JI8F MDL No:MFCD00082201
Product Description
Catalog Number:
AG00JI8F
Chemical Name:
(2-methyl-1H-imidazole-4,5-diyl)dimethanol
CAS Number:
85610-16-8
Molecular Formula:
C6H10N2O2
Molecular Weight:
142.1558
MDL Number:
MFCD00082201
IUPAC Name:
[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol
InChI:
InChI=1S/C6H10N2O2/c1-4-7-5(2-9)6(3-10)8-4/h9-10H,2-3H2,1H3,(H,7,8)
InChI Key:
CIZIDJCTTRZYBO-UHFFFAOYSA-N
SMILES:
OCc1[nH]c(nc1CO)C
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.074g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
142.158g/mol
Monoisotopic Mass:
142.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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