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831197-08-1 | Pyrrolidine, 1-[(acetyloxy)acetyl]-2-methyl-, (2R)-
CAS No: 831197-08-1 Catalog No: AG004WDE MDL No:
Product Description
Catalog Number:
AG004WDE
Chemical Name:
Pyrrolidine, 1-[(acetyloxy)acetyl]-2-methyl-, (2R)-
CAS Number:
831197-08-1
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
IUPAC Name:
[2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxoethyl] acetate
InChI:
InChI=1S/C9H15NO3/c1-7-4-3-5-10(7)9(12)6-13-8(2)11/h7H,3-6H2,1-2H3/t7-/m1/s1
InChI Key:
KKNDYNIKAFMZQF-SSDOTTSWSA-N
SMILES:
CC(=O)OCC(=O)N1CCC[C@H]1C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
185.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.223g/mol
Monoisotopic Mass:
185.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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