Home Carboxys 4-Ethyl-1H-imidazole-5-carboxylic acid hydrochloride

4-Ethyl-1H-imidazole-5-carboxylic acid hydrochloride

CAS No.:
701298-44-4
Catalog Number:
AG01B276
Molecular Formula:
C6H9ClN2O2
Molecular Weight:
176.6009
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B276
Chemical Name:
4-Ethyl-1H-imidazole-5-carboxylic acid hydrochloride
CAS Number:
701298-44-4
Molecular Formula:
C6H9ClN2O2
Molecular Weight:
176.6009
MDL Number:
MFCD29038156
IUPAC Name:
5-ethyl-1H-imidazole-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H8N2O2.ClH/c1-2-4-5(6(9)10)8-3-7-4;/h3H,2H2,1H3,(H,7,8)(H,9,10);1H
InChI Key:
OCPASIWLCDEYKY-UHFFFAOYSA-N
SMILES:
CCc1nc[nH]c1C(=O)O.Cl
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
176.6g/mol
Monoisotopic Mass:
176.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties