Home Other Building Blocks 2-hydroxy-2-(1-methyl-1H-imidazol-5-yl)acetic acid hydrochloride

2-hydroxy-2-(1-methyl-1H-imidazol-5-yl)acetic acid hydrochloride

CAS No.:
1798725-94-6
Catalog Number:
AG01BGBQ
Molecular Formula:
C6H9ClN2O3
Molecular Weight:
192.6003
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Product Description
Catalog Number:
AG01BGBQ
Chemical Name:
2-hydroxy-2-(1-methyl-1H-imidazol-5-yl)acetic acid hydrochloride
CAS Number:
1798725-94-6
Molecular Formula:
C6H9ClN2O3
Molecular Weight:
192.6003
MDL Number:
MFCD28125078
IUPAC Name:
2-hydroxy-2-(3-methylimidazol-4-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C6H8N2O3.ClH/c1-8-3-7-2-4(8)5(9)6(10)11;/h2-3,5,9H,1H3,(H,10,11);1H
InChI Key:
LBUDHTLDIAKEAJ-UHFFFAOYSA-N
SMILES:
Cn1cncc1C(C(=O)O)O.Cl
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
192.599g/mol
Monoisotopic Mass:
192.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties