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1234576-84-1

1234576-84-1 | Pyrrolidine, 3-(methylsulfonyl)-, (3R)-

CAS No: 1234576-84-1 Catalog No: AG000KLX MDL No:MFCD17015903

Product Description

Catalog Number:
AG000KLX
Chemical Name:
Pyrrolidine, 3-(methylsulfonyl)-, (3R)-
CAS Number:
1234576-84-1
Molecular Formula:
C5H11NO2S
Molecular Weight:
149.2113
MDL Number:
MFCD17015903
IUPAC Name:
(3R)-3-methylsulfonylpyrrolidine
InChI:
InChI=1S/C5H11NO2S/c1-9(7,8)5-2-3-6-4-5/h5-6H,2-4H2,1H3/t5-/m1/s1
InChI Key:
XCEGFNRUBBVHJT-RXMQYKEDSA-N
SMILES:
CS(=O)(=O)[C@H]1CNCC1

Properties

Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
149.051g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.208g/mol
Monoisotopic Mass:
149.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  

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