tert-butyl 3-fluoro-3-(hydroxymethyl)azetidine-1-carboxylate

tert-butyl 3-fluoro-3-(hydroxymethyl)azetidine-1-carboxylate

CAS: 1126650-66-5

Formula: C9H16FNO3

SMILES: CC(C)(C)OC(=O)N1CC(F)(CO)C1

IUPAC: tert-butyl 3-fluoro-3-(hydroxymethyl)azetidine-1-carboxylate

InChI: InChI=1S/C9H16FNO3/c1-8(2,3)14-7(13)11-4-9(10,5-11)6-12/h12H,4-6H2,1-3H3

Composition: C (52.67%), H (7.86%), F (9.26%), N (6.83%), O (23.39%)

Molar Mass: 205.229

Atom Count: 30

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	205.111421542
Formal Charge	0
FSP3	0.89
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	BONSKTIHNARTGJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.17
Topological Polar Surface Area	49.77
Polarizability	18.95
Ring Count	1
Rotatable Bond Count	3

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