Propanoic acid,3,3',3''-phosphinidynetris- supplier

Name
tris(2-carboxyethyl)phosphine
EINECS
CAS No. 5961-85-3
Article Data4
CAS DataBase
Density
Solubility
Melting Point
Formula C₉H₁₅O₆P
Boiling Point 519.4 °C at 760 mmHg
Molecular Weight 250.188
Flash Point 267.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Tris(2-carboxyethyl)phosphine;Tris(carboxyethyl)phosphine;Propionicacid, 3,3',3''-phosphinidynetri- (7CI,8CI);3,3',3''-Phosphinidynetripropionicacid;3,3',3''-Phosphinidynetris[propanoic acid];Phosphine,tris(2-carboxyethyl)-;
PSA 125.49000
LogP 0.89240

Propanoic acid,3,3',3''-phosphinidynetris- Specification

The CAS registry number of Propanoic acid,3,3',3''-phosphinidynetris- is 5961-85-3. This chemical is also named as 3,3',3''-Phosphanetriyltripropanoic acid. In addition, its molecular formula is C₉H₁₅O₆P and molecular weight is 250.1856. Its IUPAC name is called 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid. This chemical's classification code is Indicators and reagents.

Physical properties about are: (1)ACD/LogP: 0.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.71; (4)ACD/LogD (pH 7.4): -5.49; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 9; (12)Flash Point: 267.9 °C; (13)Enthalpy of Vaporization: 86.67 kJ/mol; (14)Boiling Point: 519.4 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CCP(CCC(=O)O)CCC(=O)O
(2)InChI: InChI=1/C9H15O6P/c10-7(11)1-4-16(5-2-8(12)13)6-3-9(14)15/h1-6H2,(H,10,11)(H,12,13)(H,14,15)
(3)InChIKey: PZBFGYYEXUXCOF-UHFFFAOYAQ

Product Name

tris(2-carboxyethyl)phosphine

Propanoic acid,3,3',3''-phosphinidynetris- Specification

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