sodium 2,3-bis(octadec-9-enoyloxy)propoxyphosphonic acid

sodium 2,3-bis(octadec-9-enoyloxy)propoxyphosphonic acid

Formula: C39H73NaO8P

SMILES: [Na+].CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(O)(O)=O)OC(=O)CCCCCCCC=CCCCCCCCC

IUPAC: sodium [2,3-bis(octadec-9-enoyloxy)propoxy]phosphonic acid

InChI: InChI=1/C39H73O8P.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h17-20,37H,3-16,21-36H2,1-2H3,(H2,42,43,44);/q;+1

Composition: C (64.70%), H (10.16%), Na (3.18%), O (17.68%), P (4.28%)

Molar Mass: 723.968

Atom Count: 122

Heavy Atom Count: 49

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	723.49352701
Formal Charge	1
FSP3	0.85
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	JUKKLZHXFHPJSF-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	199.21
Topological Polar Surface Area	119.36
Polarizability	78.45
Ring Count	0
Rotatable Bond Count	38

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C39H73NaO8P		Quote Only