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1803590-16-0,MFCD28118487
Catalog No.:AA01BF27
1803590-16-0 | methyl 3-hydroxypyridine-4-carboxylate hydrochloride
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Technical Information
Catalog Number:
AA01BF27
Chemical Name:
methyl 3-hydroxypyridine-4-carboxylate hydrochloride
CAS Number:
1803590-16-0
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
MDL Number:
MFCD28118487
IUPAC Name:
methyl 3-hydroxypyridine-4-carboxylate;hydrochloride
InChI:
InChI=1S/C7H7NO3.ClH/c1-11-7(10)5-2-3-8-4-6(5)9;/h2-4,9H,1H3;1H
InChI Key:
RHFQIRCZAIEUOK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccncc1O.Cl
Properties
Computed Properties
 
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.019g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.595g/mol
Monoisotopic Mass:
189.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
methyl 3-hydroxypyridine-4-carboxylate hydrochloride 
1803590-16-0 
Literature
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