Home Other Building Blocks 4-oxo-4-(pyridin-2-yl)butanoic acid hydrochloride

4-oxo-4-(pyridin-2-yl)butanoic acid hydrochloride

CAS No.:
1803606-28-1
Catalog Number:
AG01ACN9
Molecular Formula:
C9H10ClNO3
Molecular Weight:
215.6336
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Product Description
Catalog Number:
AG01ACN9
Chemical Name:
4-oxo-4-(pyridin-2-yl)butanoic acid hydrochloride
CAS Number:
1803606-28-1
Molecular Formula:
C9H10ClNO3
Molecular Weight:
215.6336
MDL Number:
MFCD26936061
IUPAC Name:
4-oxo-4-pyridin-2-ylbutanoic acid;hydrochloride
InChI:
InChI=1S/C9H9NO3.ClH/c11-8(4-5-9(12)13)7-3-1-2-6-10-7;/h1-3,6H,4-5H2,(H,12,13);1H
InChI Key:
MERGXRUIQOIIEQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(=O)c1ccccn1.Cl
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.035g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.633g/mol
Monoisotopic Mass:
215.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties