Home Halogens 4-chloro-5-ethyl-1H-imidazole-2-carboxylic acid hydrochloride

4-chloro-5-ethyl-1H-imidazole-2-carboxylic acid hydrochloride

CAS No.:
2138116-85-3
Catalog Number:
AG01EK61
Molecular Formula:
C6H8Cl2N2O2
Molecular Weight:
211.0459
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Product Description
Catalog Number:
AG01EK61
Chemical Name:
4-chloro-5-ethyl-1H-imidazole-2-carboxylic acid hydrochloride
CAS Number:
2138116-85-3
Molecular Formula:
C6H8Cl2N2O2
Molecular Weight:
211.0459
MDL Number:
MFCD31559866
IUPAC Name:
4-chloro-5-ethyl-1H-imidazole-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H7ClN2O2.ClH/c1-2-3-4(7)9-5(8-3)6(10)11;/h2H2,1H3,(H,8,9)(H,10,11);1H
InChI Key:
LYFFSWDERDAHPH-UHFFFAOYSA-N
SMILES:
CCc1[nH]c(nc1Cl)C(=O)O.Cl
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.996g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
211.042g/mol
Monoisotopic Mass:
209.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties