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Home Other Building Blocks Oxirane, 2,2'-[1,3-phenylenebis(oxymethylene)]bis-

Oxirane, 2,2'-[1,3-phenylenebis(oxymethylene)]bis-

CAS No.:
101-90-6
Catalog Number:
AG0003GT
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
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Product Description
Catalog Number:
AG0003GT
Chemical Name:
Oxirane, 2,2'-[1,3-phenylenebis(oxymethylene)]bis-
CAS Number:
101-90-6
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD00078378
IUPAC Name:
2-[[3-(oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
InChI:
InChI=1S/C12H14O4/c1-2-9(13-5-11-7-15-11)4-10(3-1)14-6-12-8-16-12/h1-4,11-12H,5-8H2
InChI Key:
WPYCRFCQABTEKC-UHFFFAOYSA-N
SMILES:
O1CC1COc1cccc(c1)OCC1OC1
EC Number:
202-987-5
NSC Number:
76621
RTECS Number:
VH1050000
UN Number:
2811
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
43.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Conformational analysis of the chemical shifts for molecules containing diastereotopic methylene protons. Journal of magnetic resonance (San Diego, Calif. : 1997) 20120101
Characterization of environmental chemicals with potential for DNA damage using isogenic DNA repair-deficient chicken DT40 cell lines. Environmental and molecular mutagenesis 20110801
Diglycidyl resorcinol ether. Report on carcinogens : carcinogen profiles 20110101
Diglycidyl resorcinol ether. Report on carcinogens : carcinogen profiles 20040101
Forestomach neoplasms in Fischer F344/N rats and B6C3F1 mice exposed to diglycidyl resorcinol ether--an epoxy resin. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 19901001
NTP Toxicology and Carcinogenesis Studies of Diglycidyl Resorcinol Ether (Technical Grade) (CAS No. 101-90-6) In F344/N Rats and B6C3F1 Mice (Gavage Studies). National Toxicology Program technical report series 19861001
Association of chemically induced forestomach cell proliferation and carcinogenesis. Cancer letters 19860901
Properties