Home Carboxys 4,5-dimethylpyridine-2-carboxylic acid hydrochloride

4,5-dimethylpyridine-2-carboxylic acid hydrochloride

CAS No.:
1802-19-3
Catalog Number:
AG01EK5N
Molecular Formula:
C8H10ClNO2
Molecular Weight:
187.6235
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Product Description
Catalog Number:
AG01EK5N
Chemical Name:
4,5-dimethylpyridine-2-carboxylic acid hydrochloride
CAS Number:
1802-19-3
Molecular Formula:
C8H10ClNO2
Molecular Weight:
187.6235
MDL Number:
MFCD31381227
IUPAC Name:
4,5-dimethylpyridine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H9NO2.ClH/c1-5-3-7(8(10)11)9-4-6(5)2;/h3-4H,1-2H3,(H,10,11);1H
InChI Key:
WHUPOHMUESSXAI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(c(c1)C)C.Cl
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.04g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
187.623g/mol
Monoisotopic Mass:
187.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties