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2095-03-6 molecular structure
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2-(4-{[4-(oxiran-2-ylmethoxy)phenyl]methyl}phenoxymethyl)oxirane

ChemBase ID: 135760
Molecular Formular: C19H20O4
Molecular Mass: 312.3597
Monoisotopic Mass: 312.13615912
SMILES and InChIs

SMILES:
c1cc(ccc1Cc1ccc(cc1)OCC1CO1)OCC1CO1
Canonical SMILES:
O1CC1COc1ccc(cc1)Cc1ccc(cc1)OCC1OC1
InChI:
InChI=1S/C19H20O4/c1-5-16(20-10-18-12-22-18)6-2-14(1)9-15-3-7-17(8-4-15)21-11-19-13-23-19/h1-8,18-19H,9-13H2
InChIKey:
XUCHXOAWJMEFLF-UHFFFAOYSA-N

Cite this record

CBID:135760 http://www.chembase.cn/molecule-135760.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(4-{[4-(oxiran-2-ylmethoxy)phenyl]methyl}phenoxymethyl)oxirane
IUPAC Traditional name
2-(4-{[4-(oxiran-2-ylmethoxy)phenyl]methyl}phenoxymethyl)oxirane
Synonyms
BFDGE
Bisphenol F diglycidyl ether
Bis[4-(glycidyloxy)phenyl]methane
4,4'-Methylenebisphenol diglycidyl ether
Bis(4-glycidyloxyphenyl)methane
Bis(4-hydroxyphenyl)methane Diglycidyl Ether
Diphenylolmethane diglycidyl ether
para-para-BFDGE
2,2'-[Methylenebis(4,1-phenyleneoxymethylene)]bisoxirane
Bis[p-(2,3-epoxypropoxy)phenyl]methane
Bisphenol F Diglycidyl Ether (90%)(Mixture of Diastereomers)
双酚 F 二缩水甘油醚
双[4-(氧化缩水甘油)苯基]甲烷
CAS Number
2095-03-6
EC Number
218-257-4
MDL Number
MFCD00799483
Beilstein Number
5349017
PubChem SID
162230033
PubChem CID
91511

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 91511 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.4322305  LogD (pH = 7.4) 3.4322305 
Log P 3.4322305  Molar Refractivity 86.211 cm3
Polarizability 34.011467 Å3 Polar Surface Area 43.52 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Chloroform expand Show data source
DMSO expand Show data source
Apperance
Clear Colourless Oil expand Show data source
Melting Point
43-48 °C(lit.) expand Show data source
Flash Point
>110 °C expand Show data source
>230 °F expand Show data source
Storage Condition
Refrigerator expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
3082 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
9 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
36/37/38-43-50/53 expand Show data source
Safety Statements
26-36/37-60-61 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H317-H319-H335-H400 expand Show data source
GHS Precautionary statements
P261-P273-P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 3082 9/PG 3 expand Show data source
Certificate of Analysis
Download expand Show data source
Empirical Formula (Hill Notation)
C19H20O4 expand Show data source

DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - B519540 external link
Bisphenol F Diglycidyl Ether is an novalac glycidyl ether (NOGE). Bisphenol F Diglycidyl Ether is found in resin used as coatings for food cans. Bisphenol F Diglycidyl Ether is a toxic conatminant with strict limitations on the amount allowed in food prod

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • García, R.S. et al.: Rap. Chem. Comm., 11, 1569 (2005)
  • • Cabado, G.C. et al.: Food Chem. Toxicol., 46, 1674 (2005)
  • • THeobald, A. et al.: Food Add. Contam., 17, 881 (2005)
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PATENTS

PATENTS

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INTERNET

INTERNET

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