tert-butyl 2-bromo-2-(diethoxyphosphoryl)acetate

tert-butyl 2-bromo-2-(diethoxyphosphoryl)acetate

CAS: 179106-93-5

Formula: C10H20BrO5P

SMILES: CCOP(=O)(OCC)C(Br)C(=O)OC(C)(C)C

IUPAC: tert-butyl 2-bromo-2-(diethoxyphosphoryl)acetate

InChI: InChI=1/C10H20BrO5P/c1-6-14-17(13,15-7-2)8(11)9(12)16-10(3,4)5/h8H,6-7H2,1-5H3

Composition: C (36.27%), H (6.09%), Br (24.13%), O (24.16%), P (9.35%)

Molar Mass: 331.143

Atom Count: 37

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	330.023174
Formal Charge	0
FSP3	0.9
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	YLZQCXBJSCWQHB-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.9
Topological Polar Surface Area	61.83
Polarizability	27.59
Ring Count	0
Rotatable Bond Count	8

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