tert-butyl (2R)-2-(bromomethyl)azetidine-1-carboxylate

tert-butyl (2R)-2-(bromomethyl)azetidine-1-carboxylate

CAS: 1363378-13-5

Formula: C9H16BrNO2

SMILES: CC(C)(C)OC(=O)N1CC[C@@H]1CBr

IUPAC: tert-butyl (2R)-2-(bromomethyl)azetidine-1-carboxylate

InChI: InChI=1S/C9H16BrNO2/c1-9(2,3)13-8(12)11-5-4-7(11)6-10/h7H,4-6H2,1-3H3/t7-/m1/s1

Composition: C (43.22%), H (6.45%), Br (31.94%), N (5.60%), O (12.79%)

Molar Mass: 250.136

Atom Count: 29

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	249.036442
Formal Charge	0
FSP3	0.89
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	YDUBHKXBYBMWRH-SSDOTTSWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.58
Topological Polar Surface Area	29.54
Polarizability	21.3
Ring Count	1
Rotatable Bond Count	3

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