4-Ethyl-N-(propan-2-yl)aniline - CAS 103093-97-6
Catalog: |
BB065859 |
Product Name: |
4-Ethyl-N-(propan-2-yl)aniline |
CAS: |
103093-97-6 |
Synonyms: |
4-Ethyl-N-isopropylaniline; 4-ethyl-N-(propan-2-yl)aniline; 4-ethyl-N-propan-2-ylaniline |
IUPAC Name: | 4-ethyl-N-propan-2-ylaniline |
Molecular Weight: | 163.26 |
Molecular Formula: | C11H17N |
Canonical SMILES: | CCC1=CC=C(C=C1)NC(C)C |
InChI: | InChI=1S/C11H17N/c1-4-10-5-7-11(8-6-10)12-9(2)3/h5-9,12H,4H2,1-3H3 |
InChI Key: | RXFIEKDCEQLLEH-UHFFFAOYSA-N |
Complexity: | 112 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.136099547 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.136099547 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 12Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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