(2S)-1,4,4-trimethylpyrrolidine-2-carboxylic acid

(2S)-1,4,4-trimethylpyrrolidine-2-carboxylic acid

CAS: 1443245-02-0

Formula: C8H15NO2

SMILES: CN1CC(C)(C)C[C@H]1C(O)=O

IUPAC: (2S)-1,4,4-trimethylpyrrolidine-2-carboxylic acid

InChI: InChI=1S/C8H15NO2/c1-8(2)4-6(7(10)11)9(3)5-8/h6H,4-5H2,1-3H3,(H,10,11)/t6-/m0/s1

Composition: C (61.12%), H (9.62%), N (8.91%), O (20.35%)

Molar Mass: 157.213

Atom Count: 26

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	157.110278727
Formal Charge	0
FSP3	0.87
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JEMJUABMNNBKBO-LURJTMIESA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.23
Topological Polar Surface Area	40.54
Polarizability	16.79
Ring Count	1
Rotatable Bond Count	1

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