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199918-49-5

199918-49-5 | L-Proline, 1-(2-propyn-1-yl)-

CAS No: 199918-49-5 Catalog No: AG002CFM MDL No:MFCD09757462

Product Description

Catalog Number:
AG002CFM
Chemical Name:
L-Proline, 1-(2-propyn-1-yl)-
CAS Number:
199918-49-5
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD09757462
IUPAC Name:
(2S)-1-prop-2-ynylpyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C8H11NO2/c1-2-5-9-6-3-4-7(9)8(10)11/h1,7H,3-6H2,(H,10,11)/t7-/m0/s1
InChI Key:
YOBBRBOMLUMFMP-ZETCQYMHSA-N
SMILES:
C#CCN1CCC[C@H]1C(=O)O

Properties

Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  

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