Name: Name:1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01EK9N
Rating: 90 (10 reviews)

1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxylic acid

CAS No.:

92010-17-8

Catalog Number:

AG01EK9N

Molecular Formula:

C11H19NO3

Molecular Weight:

213.2735

Catalog Number:

AG01EK9N

Chemical Name:

1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxylic acid

CAS Number:

92010-17-8

Molecular Formula:

C11H19NO3

Molecular Weight:

213.2735

MDL Number:

MFCD31559672

IUPAC Name:

(2S)-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C11H19NO3/c1-11(2,3)7-9(13)12-6-4-5-8(12)10(14)15/h8H,4-7H2,1-3H3,(H,14,15)/t8-/m0/s1

InChI Key:

ICGZUNNKSIRQNH-QMMMGPOBSA-N

SMILES:

OC(=O)C1CCCN1C(=O)CC(C)(C)C

Complexity:

268

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

213.277g/mol

Monoisotopic Mass:

213.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7