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Home Other Building Blocks methyl 4-oxo-4-(pyrrolidin-2-yl)butanoate hydrochloride

methyl 4-oxo-4-(pyrrolidin-2-yl)butanoate hydrochloride

CAS No.:
532410-51-8
Catalog Number:
AG01EK0K
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
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Product Description
Catalog Number:
AG01EK0K
Chemical Name:
methyl 4-oxo-4-(pyrrolidin-2-yl)butanoate hydrochloride
CAS Number:
532410-51-8
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
MDL Number:
MFCD19216368
IUPAC Name:
methyl 4-oxo-4-pyrrolidin-2-ylbutanoate;hydrochloride
InChI:
InChI=1S/C9H15NO3.ClH/c1-13-9(12)5-4-8(11)7-3-2-6-10-7;/h7,10H,2-6H2,1H3;1H
InChI Key:
OLKINOSOCNHUTP-UHFFFAOYSA-N
SMILES:
COC(=O)CCC(=O)C1CCCN1.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:
221.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.681g/mol
Monoisotopic Mass:
221.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties