1-Pyrrolidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester


Chemical Name: 1-Pyrrolidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester
CAS Number: 476493-40-0
Product Number: AG00D82K(AGN-PC-0KKLAQ)
Synonyms:
MDL No: MFCD03001709
Molecular Formula: C10H16N2O2
Molecular Weight: 196.2462

Identification/Properties


Properties
BP:
307.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
196.25g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
196.121g/mol
Monoisotopic Mass:
196.121g/mol
Topological Polar Surface Area:
53.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
272
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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