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168049-26-1 | 1-Pyrrolidinecarboxylic acid, 2-(azidomethyl)-, 1,1-dimethylethyl ester, (2S)-
CAS No: 168049-26-1 Catalog No: AG001XRP MDL No:MFCD12406803
Product Description
Catalog Number:
AG001XRP
Chemical Name:
1-Pyrrolidinecarboxylic acid, 2-(azidomethyl)-, 1,1-dimethylethyl ester, (2S)-
CAS Number:
168049-26-1
Molecular Formula:
C10H18N4O2
Molecular Weight:
226.2755
MDL Number:
MFCD12406803
IUPAC Name:
tert-butyl (2S)-2-(azidomethyl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H18N4O2/c1-10(2,3)16-9(15)14-6-4-5-8(14)7-12-13-11/h8H,4-7H2,1-3H3/t8-/m0/s1
InChI Key:
HRLUZSSGBKDEGK-QMMMGPOBSA-N
SMILES:
[N-]=[N+]=NC[C@@H]1CCCN1C(=O)OC(C)(C)C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
226.143g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.28g/mol
Monoisotopic Mass:
226.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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