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9004-24-4

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Basic Information
CAS No.: 9004-24-4
Name: 2-decoxyethoxyphosphonic acid
Molecular Structure:
Molecular Structure of 9004-24-4 (2-decoxyethoxyphosphonic acid)
Formula: C12H27O5P
Molecular Weight: 0
Synonyms: 2-decoxyethoxyphosphonic acid
Density: 1.092g/cm3
Boiling Point: 404.9°Cat760mmHg
Flash Point: 198.7°C
Safety: Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 248.79000
LogP: -0.05550
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Chemistry


IUPAC Name: 2-decoxyethyl dihydrogen phosphate
Molecular Weight: 282.313541 g/mol
Molecular Formula: C12H27O5P
Density: 1.092 g/cm3 
Boiling Point: 404.9 °C at 760 mmHg 
Flash Point: 198.7 °C
Molar Volume: 258.5 cm3
Polarizability: 28.17*10-24cm3
Surface Tension: 41 dyne/cm 
Enthalpy of Vaporization: 72.03 kJ/mol
Vapour Pressure: 1.09E-07 mmHg at 25°C
XLogP3-AA: 2.8
H-Bond Donor: 2
H-Bond Acceptor: 5
Rotatable Bond Count: 13
Exact Mass: 282.15961
MonoIsotopic Mass: 282.15961
Topological Polar Surface Area: 76
Heavy Atom Count: 18
Complexity: 217
Canonical SMILES: CCCCCCCCCCOCCOP(=O)(O)O
InChI: InChI=1S/C12H27O5P/c1-2-3-4-5-6-7-8-9-10-16-11-12-17-18(13,14)15/h2-12H2,1H3,(H2,13,14,15)
InChIKey: PMYUFCGBHZHZNW-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-rat LD :>5 g/kg

     FOREAE    Food Research. 9 (1944),175.
2.    

orl-rbt LD :>5 g/kg

     FOREAE    Food Research. 9 (1944),175.
3.    

orl-gpg LD :>5 g/kg

     FOREAE    Food Research. 9 (1944),175.

Safety Profile

Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.

Specification

 Aluminium carboxymethyl cellulose (CAS NO.9004-24-4) is also called Aluminium CM-cellulose ; Aluminium ; carboxymethyl cellulose ; Aluminium cellulose glucolate ; Carboxymethocel A ; Nymcel WV-L . Aluminium carboxymethyl cellulose (CAS NO.9004-24-4) is low toxic. It is flammable. It will produce stimulus smoke when buring. So the storage environment should be ventilate, low-temperature and dry. Keep Aluminium carboxymethyl cellulose (CAS NO.9004-24-4) separate from raw materials of food.