tert-butyl 3,3-bis(bromomethyl)azetidine-1-carboxylate

tert-butyl 3,3-bis(bromomethyl)azetidine-1-carboxylate

CAS: 2098131-64-5

Formula: C10H17Br2NO2

SMILES: CC(C)(C)OC(=O)N1CC(CBr)(CBr)C1

IUPAC: tert-butyl 3,3-bis(bromomethyl)azetidine-1-carboxylate

InChI: InChI=1S/C10H17Br2NO2/c1-9(2,3)15-8(14)13-6-10(4-11,5-12)7-13/h4-7H2,1-3H3

Composition: C (35.01%), H (5.00%), Br (46.58%), N (4.08%), O (9.33%)

Molar Mass: 343.059

Atom Count: 32

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	340.962605
Formal Charge	0
FSP3	0.9
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	PTPMUVBEPVNPSQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.96
Topological Polar Surface Area	29.54
Polarizability	26.08
Ring Count	1
Rotatable Bond Count	4

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