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2197-63-9 molecular structure
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bis(hexadecyloxy)phosphinic acid

ChemBase ID: 102406
Molecular Formular: C32H67O4P
Molecular Mass: 546.845741
Monoisotopic Mass: 546.47769725
SMILES and InChIs

SMILES:
CCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCC
Canonical SMILES:
CCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCC)O
InChI:
InChI=1S/C32H67O4P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-37(33,34)36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3,(H,33,34)
InChIKey:
RNPXCFINMKSQPQ-UHFFFAOYSA-N

Cite this record

CBID:102406 http://www.chembase.cn/molecule-102406.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(hexadecyloxy)phosphinic acid
IUPAC Traditional name
dicetylphosphate
dicetyl phosphate
Synonyms
Dihexadecyl phosphate
DICETYL PHOSPHATE FREE ACID
DHP
Dihexadecyl phosphate
Dicetyl phosphate
DICETYL PHOSPHATE
磷酸二鲸蜡酯
双十六烷基磷酸酯
CAS Number
2197-63-9
EC Number
218-594-7
MDL Number
MFCD00008999
Beilstein Number
1717117
PubChem SID
162090270
24893702
PubChem CID
75143

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 1.9410069  H Acceptors
H Donor LogD (pH = 5.5) 10.7043705 
LogD (pH = 7.4) 10.677222  Log P 13.053264 
Molar Refractivity 161.7877 cm3 Polarizability 64.77168 Å3
Polar Surface Area 55.76 Å2 Rotatable Bonds 32 
Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
74-75 °C(lit.) expand Show data source
74-75°C expand Show data source
76-80 °C (dec.) expand Show data source
Storage Condition
0°C expand Show data source
RTECS
MM0225450 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
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German water hazard class
3 expand Show data source
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Storage Temperature
-20°C expand Show data source
Purity
≥98.0% (TLC) expand Show data source
99% expand Show data source
Grade
purum expand Show data source
Certificate of Analysis
Download expand Show data source
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Description
anionic expand Show data source
Linear Formula
[CH3(CH2)15O]2P(O)OH expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05215152 external link
MP Biomedicals Rare Chemical collection
MP Biomedicals - 02101546 external link
Free Acid
Crystalline
Sigma Aldrich - D2631 external link
Biochem/physiol Actions
Dihexadecyl phosphate (DHP) is a negatively charged lipid that is used for the formation of model membranes.
包装
5, 10, 25 g in poly bottle
Sigma Aldrich - 37170 external link
Other Notes
Used in the preparation of DHP vesicles in membrane studies1,2,3

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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