| CAS Number | 875238-90-7 |
| Catalog Number | AG019V5H |
| Chemical Name | 3-[(2-methoxyethoxy)methyl]aniline |
| IUPAC Name | 3-(2-methoxyethoxymethyl)aniline |
| InChI | InChI=1S/C10H15NO2/c1-12-5-6-13-8-9-3-2-4-10(11)7-9/h2-4,7H,5-6,8,11H2,1H3 |
| InChI Key | VFELUXRQPZTTRP-UHFFFAOYSA-N |
| MDL Number | MFCD09808175 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | COCCOCC1=CC(N)=CC=C1 |
| Synonyms | 3-[(2-methoxyethoxy)methyl]aniline,
875238-90-7,
AC1Q4GCD,
SCHEMBL8256843,
CTK7B3864,
ZINC19406777,
AKOS000161173,
MCULE-2724916203,
NE61686,
EN300-43808,
Z1270348115,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.235g/mol |
| Monoisotopic Mass | 181.11g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number