| CAS Number | 1003013-76-0 |
| Catalog Number | AG0001IS(AGN-PC-0WD6G0) |
| Chemical Name | 3-((Benzyloxy)methyl)oxetane |
| IUPAC Name | 3-(phenylmethoxymethyl)oxetane |
| InChI | InChI=1S/C11H14O2/c1-2-4-10(5-3-1)6-12-7-11-8-13-9-11/h1-5,11H,6-9H2 |
| InChI Key | KUTKSFHVQSBUNA-UHFFFAOYSA-N |
| MDL Number | MFCD20482348 |
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.2277 |
| SMILES | C1(COCC2=CC=CC=C2)COC1 |
| Synonyms | 3-((Benzyloxy)methyl)oxetane,
1003013-76-0,
3-[(Benzyloxy)methyl]oxetane,
AK165809,
3-(benzyloxymethyl)oxetane,
3-benzyloxymethyl-oxetane,
SCHEMBL1865729,
KUTKSFHVQSBUNA-UHFFFAOYSA-N,
CS-D1246,
KS-00000SI5,
MFCD20482348,
Oxetane, 3-[(phenylmethoxy)methyl]-,
ZINC117361829,
DS-9037,
FCH1562669,
FT-0707874,
3-((benzyloxy)methyl)oxetane, 95% - 1G 1g,
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| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.231g/mol |
| Monoisotopic Mass | 178.099g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number