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138813-35-1 | Glycine, N-[1-[(1,1-dimethylethoxy)carbonyl]-5-oxo-L-prolyl]- (9CI)
CAS No: 138813-35-1 Catalog No: AG0019N9 MDL No:
Product Description
Catalog Number:
AG0019N9
Chemical Name:
Glycine, N-[1-[(1,1-dimethylethoxy)carbonyl]-5-oxo-L-prolyl]- (9CI)
CAS Number:
138813-35-1
Molecular Formula:
C12H18N2O6
Molecular Weight:
286.2811
IUPAC Name:
2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxopyrrolidine-2-carbonyl]amino]acetic acid
InChI:
InChI=1S/C12H18N2O6/c1-12(2,3)20-11(19)14-7(4-5-8(14)15)10(18)13-6-9(16)17/h7H,4-6H2,1-3H3,(H,13,18)(H,16,17)
InChI Key:
FGTBAGLNLMOMNO-UHFFFAOYSA-N
SMILES:
OC(=O)CNC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.284g/mol
Monoisotopic Mass:
286.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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