11-[(2-bromo-2-methylpropanoyl)oxy]undecylphosphonic acid

11-[(2-bromo-2-methylpropanoyl)oxy]undecylphosphonic acid

Formula: C15H30BrO5P

SMILES: CC(C)(Br)C(=O)OCCCCCCCCCCCP(O)(O)=O

IUPAC: {11-[(2-bromo-2-methylpropanoyl)oxy]undecyl}phosphonic acid

InChI: InChI=1S/C15H30BrO5P/c1-15(2,16)14(17)21-12-10-8-6-4-3-5-7-9-11-13-22(18,19)20/h3-13H2,1-2H3,(H2,18,19,20)

Composition: C (44.90%), H (7.54%), Br (19.91%), O (19.94%), P (7.72%)

Molar Mass: 401.278

Atom Count: 52

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	400.101424
Formal Charge	0
FSP3	0.93
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	SBFNQWAMVLRANY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.41
Topological Polar Surface Area	83.83
Polarizability	36.16
Ring Count	0
Rotatable Bond Count	14

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Purity	LeadTime	Formula		UnitPrice
98%	<14 Days	C15H30BrO5P		Quote Only