1-[(benzyloxy)carbonyl]-4,4-dimethylpyrrolidine-2-carboxylic acid

1-[(benzyloxy)carbonyl]-4,4-dimethylpyrrolidine-2-carboxylic acid

CAS: 2097068-36-3

Formula: C15H19NO4

SMILES: CC1(C)CC(N(C1)C(=O)OCC1=CC=CC=C1)C(O)=O

IUPAC: 1-[(benzyloxy)carbonyl]-4,4-dimethylpyrrolidine-2-carboxylic acid

InChI: InChI=1/C15H19NO4/c1-15(2)8-12(13(17)18)16(10-15)14(19)20-9-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,17,18)

Composition: C (64.97%), H (6.91%), N (5.05%), O (23.08%)

Molar Mass: 277.32

Atom Count: 39

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	277.131408096
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	OCDAHHCZFHVXML-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.74
Topological Polar Surface Area	66.84
Polarizability	28.61
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	2097068-36-3		$171.35-$4,048.00$171.35$227.70$339.25$563.50$1,012.00$4,048.00