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58555-20-7 | 2-METHYL-3-(2-METHYL-BENZOIMIDAZOL-1-YL)-PROPIONIC ACID
CAS No: 58555-20-7 Catalog No: AG01AR5E MDL No:MFCD07801122
Product Description
Catalog Number:
AG01AR5E
Chemical Name:
2-METHYL-3-(2-METHYL-BENZOIMIDAZOL-1-YL)-PROPIONIC ACID
CAS Number:
58555-20-7
MDL Number:
MFCD07801122
IUPAC Name:
2-methyl-3-(2-methylbenzimidazol-1-yl)propanoic acid
InChI:
InChI=1S/C12H14N2O2/c1-8(12(15)16)7-14-9(2)13-10-5-3-4-6-11(10)14/h3-6,8H,7H2,1-2H3,(H,15,16)
InChI Key:
NCUQGGHIAQQHRV-UHFFFAOYSA-N
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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