| CAS Number | 918445-10-0 |
| Catalog Number | AG006EW8(AGN-PC-0NT1JC) |
| Chemical Name | 2-methyl-5-(propan-2-yloxy)aniline |
| IUPAC Name | 2-methyl-5-propan-2-yloxyaniline |
| InChI | InChI=1S/C10H15NO/c1-7(2)12-9-5-4-8(3)10(11)6-9/h4-7H,11H2,1-3H3 |
| InChI Key | ZWCXUSBRKRTYFL-UHFFFAOYSA-N |
| MDL Number | MFCD11934533 |
| Molecular Formula | C10H15NO |
| Molecular Weight | 165.2322 |
| SMILES | CC(C)Oc1ccc(C)c(N)c1 |
| Synonyms | 5-Isopropoxy-2-methylaniline,
918445-10-0,
5-isopropoxy-2-methylbenzenamine,
Benzenamine, 2-methyl-5-(1-methylethoxy)-,
SCHEMBL4232206,
CTK3H7346,
DTXSID10653561,
ZWCXUSBRKRTYFL-UHFFFAOYSA-N,
2-Methyl-5-propan-2-yloxyaniline,
MFCD11934533,
ZINC32006330,
2-Methyl-5-[(propan-2-yl)oxy]aniline,
DA-01108,
CS-0038999,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.236g/mol |
| Monoisotopic Mass | 165.115g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^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