(2S,4R)-4-((tert-Butoxycarbonyl)amino)pyrrolidine-2-carboxylic acid


Chemical Name: (2S,4R)-4-((tert-Butoxycarbonyl)amino)pyrrolidine-2-carboxylic acid
CAS Number: 1279034-98-8
Product Number: AG000XK0(AGN-PC-0WA1XD)
Synonyms:
MDL No:
Molecular Formula: C10H18N2O4
Molecular Weight: 230.2609

Identification/Properties


Computed Properties
Molecular Weight:
230.264g/mol
XLogP3:
-2
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
230.127g/mol
Monoisotopic Mass:
230.127g/mol
Topological Polar Surface Area:
87.7A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
285
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


PNMR/2S4R-4-tert-butoxycarbonylaminopyrrolidine-2-carboxylic_acid-1279034-98-8-HNMR.pdf

Other Analytical Data


POTHER/2S4R-4-tert-butoxycarbonylaminopyrrolidine-2-carboxylic_acid-1279034-98-8-LCMS.pdf

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