| CAS Number | 13807-89-1 |
| Catalog Number | AG00HV84(AGN-PC-0MY1L9) |
| Chemical Name | Ethanol, 2-[(4-methoxyphenyl)methoxy]- |
| IUPAC Name | 2-[(4-methoxyphenyl)methoxy]ethanol |
| InChI | InChI=1S/C10H14O3/c1-12-10-4-2-9(3-5-10)8-13-7-6-11/h2-5,11H,6-8H2,1H3 |
| InChI Key | PHXZOQVBYCJBHO-UHFFFAOYSA-N |
| MDL Number | MFCD12756484 |
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.2164 |
| SMILES | COc1ccc(cc1)COCCO |
| Synonyms | 13807-89-1,
2-((4-Methoxybenzyl)oxy)ethanol,
2-(4-METHOXYBENZYLOXY)ETHANOL,
Ethanol, 2-[(4-methoxyphenyl)methoxy]-,
AK481227,
SCHEMBL4741980,
DTXSID10434852,
MFCD12756484,
ZINC72266144,
AKOS006346591,
2-[(4-Methoxyphenyl)methoxy]ethan-1-ol,
DS-18913,
2-[(4-methoxyphenyl)methoxy]ethanol,
CID10058160,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.219g/mol |
| Monoisotopic Mass | 182.094g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number