2-[[2-(oxiran-2-ylmethoxy)-3-(oxiran-2-ylmethyl)phenyl]methyl]oxirane - CAS 13561-08-5
Catalog: |
BB053651 |
Product Name: |
2-[[2-(oxiran-2-ylmethoxy)-3-(oxiran-2-ylmethyl)phenyl]methyl]oxirane |
CAS: |
13561-08-5 |
Synonyms: |
Oxirane, 2,2-[[2-(oxiraneylMethoxy)-1,3-phenylene]bis(Methylene)]Bis- |
IUPAC Name: | 2-[[2,6-bis(oxiran-2-ylmethyl)phenoxy]methyl]oxirane |
Molecular Weight: | 262.30 |
Molecular Formula: | C15H18O4 |
Canonical SMILES: | C1C(O1)CC2=C(C(=CC=C2)CC3CO3)OCC4CO4 |
InChI: | InChI=1S/C15H18O4/c1-2-10(4-12-6-16-12)15(19-9-14-8-18-14)11(3-1)5-13-7-17-13/h1-3,12-14H,4-9H2 |
InChI Key: | PPEASEWKOGNDKZ-UHFFFAOYSA-N |
Appearance: | Yellow liquid |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity] |
Precautionary Statement: | P203, P261, P264, P264+P265, P272, P280, P281, P302+P352, P305+P351+P338, P318, P321, P332+P317, P333+P313, P337+P317, P362+P364, P405, and P501 |
Signal Word: | Warning |
Complexity: | 299 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.12050905 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.12050905 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 46.8 |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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