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1004538-33-3 | 1-Pyrrolidinecarboxylic acid, 3-(dimethylamino)-, 1,1-dimethylethyl ester, (3R)-
CAS No: 1004538-33-3 Catalog No: AG00021H MDL No:MFCD11053517
Product Description
Catalog Number:
AG00021H
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-(dimethylamino)-, 1,1-dimethylethyl ester, (3R)-
CAS Number:
1004538-33-3
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
MDL Number:
MFCD11053517
IUPAC Name:
tert-butyl (3R)-3-(dimethylamino)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-6-9(8-13)12(4)5/h9H,6-8H2,1-5H3/t9-/m1/s1
InChI Key:
SOFNSBHMEVBTNR-SECBINFHSA-N
SMILES:
CN([C@@H]1CCN(C1)C(=O)OC(C)(C)C)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
214.168g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.309g/mol
Monoisotopic Mass:
214.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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