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1289689-32-2 | 1-Pyrrolidinecarboxylic acid, 3-methyl-, 1,1-dimethylethyl ester, (3R)-
CAS No: 1289689-32-2 Catalog No: AG000YPW MDL No:
Product Description
Catalog Number:
AG000YPW
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-methyl-, 1,1-dimethylethyl ester, (3R)-
CAS Number:
1289689-32-2
Molecular Formula:
C10H19NO2
Molecular Weight:
185.2634
IUPAC Name:
tert-butyl 3-methylpyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H19NO2/c1-8-5-6-11(7-8)9(12)13-10(2,3)4/h8H,5-7H2,1-4H3
InChI Key:
JQXFBJIDTLTFNU-UHFFFAOYSA-N
SMILES:
C[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.267g/mol
Monoisotopic Mass:
185.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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