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25550-98-5 molecular structure
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bis(8-methylnonyl) phenyl phosphite

ChemBase ID: 137016
Molecular Formular: C26H47O3P
Molecular Mass: 438.623341
Monoisotopic Mass: 438.32628199
SMILES and InChIs

SMILES:
CC(C)CCCCCCCOP(OCCCCCCCC(C)C)Oc1ccccc1
Canonical SMILES:
CC(CCCCCCCOP(Oc1ccccc1)OCCCCCCCC(C)C)C
InChI:
InChI=1S/C26H47O3P/c1-24(2)18-12-7-5-9-16-22-27-30(29-26-20-14-11-15-21-26)28-23-17-10-6-8-13-19-25(3)4/h11,14-15,20-21,24-25H,5-10,12-13,16-19,22-23H2,1-4H3
InChIKey:
SXXILWLQSQDLDL-UHFFFAOYSA-N

Cite this record

CBID:137016 http://www.chembase.cn/molecule-137016.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(8-methylnonyl) phenyl phosphite
IUPAC Traditional name
bis(8-methylnonyl) phenyl phosphite
Synonyms
Diisodecylphenyl phosphite
亚磷酸苯基二异癸基酯
CAS Number
25550-98-5
EC Number
247-098-3
MDL Number
MFCD00015058
PubChem SID
162231282
24867750
PubChem CID
16212880

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
442240 external link Add to cart Please log in.
Data Source Data ID
PubChem 16212880 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 9.6264  LogD (pH = 7.4) 9.6264 
Log P 9.6264  Molar Refractivity 130.6087 cm3
Polarizability 51.951668 Å3 Polar Surface Area 27.69 Å2
Rotatable Bonds 20  Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
176 °C/5 mmHg(lit.) expand Show data source
Flash Point
113 °C expand Show data source
235.4 °F expand Show data source
Density
0.94 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.48(lit.) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319 expand Show data source
GHS Precautionary statements
P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
Linear Formula
(C10H21O)2POC6H5 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 442240 external link
Application
Heat stabilizer for polymers

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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