| CAS Number | 10141-51-2 |
| Catalog Number | AG0004FM(AGN-PC-00SM9M) |
| Chemical Name | Benzenamine, 4-(3-methylbutoxy)-, hydrochloride (9CI) |
| IUPAC Name | 4-(3-methylbutoxy)aniline;hydrochloride |
| InChI | InChI=1S/C11H17NO.ClH/c1-9(2)7-8-13-11-5-3-10(12)4-6-11;/h3-6,9H,7-8,12H2,1-2H3;1H |
| InChI Key | GFESZSNFRSACMU-UHFFFAOYSA-N |
| MDL Number | MFCD05863938 |
| Molecular Formula | C11H18ClNO |
| Molecular Weight | 215.7197 |
| SMILES | Cl.C(CC(C)C)OC1=CC=C(N)C=C1 |
| Synonyms | 10141-51-2,
CP 24,879 (hydrochloride),
CP-24879 hydrochloride,
p-Isopentoxyaniline,
CTK8F8801,
DTXSID90582022,
4-(isopentyloxy)aniline hydrochloride,
4-(3-Methylbutoxy)benzenamine hydrochloride,
SR-01000946202,
CP-24879 hydrochloride, >=98% (HPLC), powder,
J-000386,
SR-01000946202-1,
4-(3-Methylbutoxy)aniline--hydrogen chloride (1/1),
Benzenamine, 4-(3-methylbutoxy)-, hydrochloride (9CI),
4-(3-methylbutoxy)aniline,hydrochloride,
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| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.721g/mol |
| Monoisotopic Mass | 215.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number