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122684-34-8 | 1-Pyrrolidinecarboxylic acid, 3-(aminocarbonyl)-, 1,1-dimethylethyl ester
CAS No: 122684-34-8 Catalog No: AG0017NA MDL No:MFCD04116210
Product Description
Catalog Number:
AG0017NA
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-(aminocarbonyl)-, 1,1-dimethylethyl ester
CAS Number:
122684-34-8
Molecular Formula:
C10H18N2O3
Molecular Weight:
214.2615
MDL Number:
MFCD04116210
IUPAC Name:
tert-butyl 3-carbamoylpyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H18N2O3/c1-10(2,3)15-9(14)12-5-4-7(6-12)8(11)13/h7H,4-6H2,1-3H3,(H2,11,13)
InChI Key:
NHDGOVOBEZPXMY-UHFFFAOYSA-N
SMILES:
NC(=O)C1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.132g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.265g/mol
Monoisotopic Mass:
214.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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