Home Carboxys (2S,4R)-4-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylic acid hydrochloride

(2S,4R)-4-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylic acid hydrochloride

CAS No.:
2137144-77-3
Catalog Number:
AG01EILU
Molecular Formula:
C8H14ClNO4
Molecular Weight:
223.6541
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Product Description
Catalog Number:
AG01EILU
Chemical Name:
(2S,4R)-4-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylic acid hydrochloride
CAS Number:
2137144-77-3
Molecular Formula:
C8H14ClNO4
Molecular Weight:
223.6541
MDL Number:
MFCD31558969
IUPAC Name:
(2S,4R)-4-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H13NO4.ClH/c1-13-7(10)3-5-2-6(8(11)12)9-4-5;/h5-6,9H,2-4H2,1H3,(H,11,12);1H/t5-,6+;/m1./s1
InChI Key:
KMPCLPHOKFBCGY-IBTYICNHSA-N
SMILES:
COC(=O)C[C@@H]1CN[C@@H](C1)C(=O)O.Cl
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
223.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
223.653g/mol
Monoisotopic Mass:
223.061g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties