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Propanoic acid,3-(diethoxyphosphinyl)-

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Name

Propanoic acid,3-(diethoxyphosphinyl)-

EINECS N/A
CAS No. 3095-96-3 Density 1.196 g/cm3
PSA 82.64000 LogP 1.72720
Solubility N/A Melting Point >15 °C
Formula C7H15O5P Boiling Point 334.4 °C at 760 mmHg
Molecular Weight 210.167 Flash Point 156 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 3095-96-3 (DIETHYLPHOSPHONOPROPANOIC ACID) Hazard Symbols IrritantXi
Synonyms

3-(Diethoxyphosphinyl)propanoic acid;Propionicacid, 3-phosphono-, P,P-diethyl ester (7CI,8CI);

Article Data 1

Propanoic acid,3-(diethoxyphosphinyl)- Specification

The CAS register number of Propanoic acid,3-(diethoxyphosphinyl)- is 3095-96-3. The systematic name about this chemical is 3-(diethoxyphosphoryl)propanoic acid. The molecular formula about this chemical is C7H15O5P and the molecular weight is 210.16.

Physical properties about Propanoic acid,3-(diethoxyphosphinyl)- are: (1)ACD/LogP: 0.09; (2)ACD/LogD (pH 5.5): -1.18; (3)ACD/LogD (pH 7.4): -2.96; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.43; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 71.64Å2; (12)Index of Refraction: 1.441; (13)Molar Refractivity: 46.4 cm3; (14)Molar Volume: 175.5 cm3; (15)Polarizability: 18.39x10-24cm3; (16)Surface Tension: 40.8 dyne/cm; (17)Flash Point: 156 °C; (18)Enthalpy of Vaporization: 63.46 kJ/mol; (19)Boiling Point: 334.4 °C at 760 mmHg; (20)Vapour Pressure: 2.45E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=P(OCC)(OCC)CCC(=O)O
(2)InChI: InChI=1/C7H15O5P/c1-3-11-13(10,12-4-2)6-5-7(8)9/h3-6H2,1-2H3,(H,8,9)
(3)InChIKey: YLIOJOOKMJEHJM-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C7H15O5P/c1-3-11-13(10,12-4-2)6-5-7(8)9/h3-6H2,1-2H3,(H,8,9)
(5)Std. InChIKey: YLIOJOOKMJEHJM-UHFFFAOYSA-N

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