1-tert-butyl 3-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate

1-tert-butyl 3-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate

CAS: 1438852-70-0

Formula: C11H18FNO4

SMILES: COC(=O)[C@@]1(F)CCN(C1)C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 3-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate

InChI: InChI=1S/C11H18FNO4/c1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4/h5-7H2,1-4H3/t11-/m1/s1

Composition: C (53.43%), H (7.34%), F (7.68%), N (5.66%), O (25.88%)

Molar Mass: 247.266

Atom Count: 35

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	247.121986227
Formal Charge	0
FSP3	0.82
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WJXDMHSZPKIZKP-LLVKDONJSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.75
Topological Polar Surface Area	55.84
Polarizability	22.81
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1438852-70-0		$224.46-$921.79$224.46$358.12$615.37$921.79