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1522-88-9 molecular structure
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1,3-diiodo-2,2-bis(iodomethyl)propane

ChemBase ID: 110981
Molecular Formular: C5H8I4
Molecular Mass: 575.7349
Monoisotopic Mass: 575.68049226
SMILES and InChIs

SMILES:
ICC(CI)(CI)CI
Canonical SMILES:
ICC(CI)(CI)CI
InChI:
InChI=1S/C5H8I4/c6-1-5(2-7,3-8)4-9/h1-4H2
InChIKey:
HPMGSGCDKVCZHC-UHFFFAOYSA-N

Cite this record

CBID:110981 http://www.chembase.cn/molecule-110981.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1,3-diiodo-2,2-bis(iodomethyl)propane
IUPAC Traditional name
1,3-diiodo-2,2-bis(iodomethyl)propane
Synonyms
PENTAERYTHRITOL TETRAIODIDE
CAS Number
1522-88-9
PubChem SID
162096999
PubChem CID
73707

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05217309 external link Add to cart Please log in.
Data Source Data ID
PubChem 73707 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 5.142873  LogD (pH = 7.4) 5.142873 
Log P 5.142873  Molar Refractivity 76.8605 cm3
Polarizability 31.35704 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
RTECS
TY1100000 expand Show data source
MSDS Link
Download expand Show data source
Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05217309 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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