Home Other Building Blocks 2-(1H-imidazol-4-yl)-2-methylpropanoic acid hydrochloride

2-(1H-imidazol-4-yl)-2-methylpropanoic acid hydrochloride

CAS No.:
51720-91-3
Catalog Number:
AG01BFPN
Molecular Formula:
C7H11ClN2O2
Molecular Weight:
190.6274
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Product Description
Catalog Number:
AG01BFPN
Chemical Name:
2-(1H-imidazol-4-yl)-2-methylpropanoic acid hydrochloride
CAS Number:
51720-91-3
Molecular Formula:
C7H11ClN2O2
Molecular Weight:
190.6274
MDL Number:
MFCD28118679
IUPAC Name:
2-(1H-imidazol-5-yl)-2-methylpropanoic acid;hydrochloride
InChI:
InChI=1S/C7H10N2O2.ClH/c1-7(2,6(10)11)5-3-8-4-9-5;/h3-4H,1-2H3,(H,8,9)(H,10,11);1H
InChI Key:
VTCYQTJVRSEMIK-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1nc[nH]c1)(C)C.Cl
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
190.627g/mol
Monoisotopic Mass:
190.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties