Name: Name:1-Pyrrolidinecarboxylic acid, 2-(cyanomethyl)-, 1,1-dimethylethyl ester, (2R)-
Brand: Angene
SKU: AG002D6D
Rating: 90 (10 reviews)

1-Pyrrolidinecarboxylic acid, 2-(cyanomethyl)-, 1,1-dimethylethyl ester, (2R)-

CAS No.:

201039-13-6

Catalog Number:

AG002D6D

Molecular Formula:

C11H18N2O2

Molecular Weight:

210.2728

Catalog Number:

AG002D6D

Chemical Name:

1-Pyrrolidinecarboxylic acid, 2-(cyanomethyl)-, 1,1-dimethylethyl ester, (2R)-

CAS Number:

201039-13-6

Molecular Formula:

C11H18N2O2

Molecular Weight:

210.2728

IUPAC Name:

tert-butyl (2R)-2-(cyanomethyl)pyrrolidine-1-carboxylate

InChI:

InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-8-4-5-9(13)6-7-12/h9H,4-6,8H2,1-3H3/t9-/m1/s1

InChI Key:

GSNDDHMLFYORQI-SECBINFHSA-N

SMILES:

N#CC[C@H]1CCCN1C(=O)OC(C)(C)C

Complexity:

285

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.137g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.277g/mol

Monoisotopic Mass:

210.137g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4