Home Other Building Blocks ethyl 2-hydroxy-2-(pyridin-3-yl)acetate hydrochloride

ethyl 2-hydroxy-2-(pyridin-3-yl)acetate hydrochloride

CAS No.:
1269151-93-0
Catalog Number:
AG01AH3S
Molecular Formula:
C9H12ClNO3
Molecular Weight:
217.6495
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Product Description
Catalog Number:
AG01AH3S
Chemical Name:
ethyl 2-hydroxy-2-(pyridin-3-yl)acetate hydrochloride
CAS Number:
1269151-93-0
Molecular Formula:
C9H12ClNO3
Molecular Weight:
217.6495
MDL Number:
MFCD18380757
IUPAC Name:
ethyl 2-hydroxy-2-pyridin-3-ylacetate;hydrochloride
InChI:
InChI=1S/C9H11NO3.ClH/c1-2-13-9(12)8(11)7-4-3-5-10-6-7;/h3-6,8,11H,2H2,1H3;1H
InChI Key:
YXYOSKWPMUPSRO-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1cccnc1)O.Cl
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.649g/mol
Monoisotopic Mass:
217.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties