| CAS Number | 102439-33-8 |
| Catalog Number | AG0007HT(AGN-PC-0165JX) |
| Chemical Name | 2-Ethoxy-5-methoxyaniline |
| IUPAC Name | 2-ethoxy-5-methoxyaniline |
| InChI | InChI=1S/C9H13NO2/c1-3-12-9-5-4-7(11-2)6-8(9)10/h4-6H,3,10H2,1-2H3 |
| InChI Key | IRRIDSMXMHAYOV-UHFFFAOYSA-N |
| MDL Number | MFCD09736306 |
| Molecular Formula | C9H13NO2 |
| Molecular Weight | 167.2050 |
| SMILES | CCOC1=C(N)C=C(OC)C=C1 |
| Synonyms | 2-ethoxy-5-methoxyaniline,
102439-33-8,
Benzenamine, 2-ethoxy-5-methoxy-,
2-ethoxy-5-methoxy-aniline,
ACMC-20m5fn,
AC1Q35MU,
SCHEMBL8507803,
CTK0D9064,
DTXSID80588533,
ZINC22215117,
AKOS000143822,
MCULE-5687005416,
NE31228,
EN300-69763,
Z1263824428,
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| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.208g/mol |
| Monoisotopic Mass | 167.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number