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108-60-1 molecular structure
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1-chloro-2-[(1-chloropropan-2-yl)oxy]propane

ChemBase ID: 162249
Molecular Formular: C6H12Cl2O
Molecular Mass: 171.06488
Monoisotopic Mass: 170.02652036
SMILES and InChIs

SMILES:
ClCC(OC(CCl)C)C
Canonical SMILES:
ClCC(OC(CCl)C)C
InChI:
InChI=1S/C6H12Cl2O/c1-5(3-7)9-6(2)4-8/h5-6H,3-4H2,1-2H3
InChIKey:
QCFYJCYNJLBDRT-UHFFFAOYSA-N

Cite this record

CBID:162249 http://www.chembase.cn/molecule-162249.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-chloro-2-[(1-chloropropan-2-yl)oxy]propane
IUPAC Traditional name
1-chloro-2-[(1-chloropropan-2-yl)oxy]propane
Synonyms
2,2'-Dichlorodiisopropyl Ether
2,2'-Oxybis(1-chloropropane)
Bis(1-chloro-2-propyl) Ether
Bis(2-chloro-1-methylethyl) Ether
DCIP (nematocide)
NSC 2849
β,β'-Dichlorodiisopropyl Ether
Bis(2-chloroisopropyl) Ether
CAS Number
108-60-1
PubChem SID
162256384
PubChem CID
7944

DATA SOURCES

DATA SOURCES

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Data Source Data ID
TRC B419020 external link Add to cart
PubChem 7944 external link
Data Source Data ID Price
TRC
B419020 external link Add to cart Please log in.
Data Source Data ID
PubChem 7944 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.2866793  LogD (pH = 7.4) 2.2866793 
Log P 2.2866793  Molar Refractivity 40.5367 cm3
Polarizability 16.186695 Å3 Polar Surface Area 9.23 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - B419020 external link
Bis(2-chloroisopropyl) Ether is an organochlorine pesticide. Bis(2-chloroisopropyl) Ether is used as a nematicide to control parasitic nematodes in agriculture.

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Chiyonishio, T. et al.: Tott.-ken Nog. Shik. Ken. Hok., 13, 29 (1973)
  • • Moreno Horn, M. et al.: 179, 234 (1973)
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PATENTS

PATENTS

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INTERNET

INTERNET

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