dimethyl benzoylphosphonate

dimethyl benzoylphosphonate

CAS: 18106-71-3

Formula: C9H11O4P

SMILES: COP(=O)(OC)C(=O)C1=CC=CC=C1

IUPAC: dimethyl benzoylphosphonate

InChI: InChI=1S/C9H11O4P/c1-12-14(11,13-2)9(10)8-6-4-3-5-7-8/h3-7H,1-2H3

Composition: C (50.48%), H (5.18%), O (29.88%), P (14.46%)

Molar Mass: 214.157

Atom Count: 25

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.039495832
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	TWNVJLOWMINFMB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.85
Topological Polar Surface Area	52.6
Polarizability	20.63
Ring Count	1
Rotatable Bond Count	4

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
%	<6 Days	18106-71-3		$295.55-$701.50$295.55$701.50