4-Methylazepan-4-ol Hydrochloride - CAS 91774-53-7
Catalog: |
BB040342 |
Product Name: |
4-Methylazepan-4-ol Hydrochloride |
CAS: |
91774-53-7 |
Synonyms: |
4-methyl-4-azepanol;hydrochloride; 4-methylazepan-4-ol;hydrochloride |
IUPAC Name: | 4-methylazepan-4-ol;hydrochloride |
Description: | 4-Methylazepan-4-ol Hydrochloride (CAS# 91774-53-7) is a useful research chemical. |
Molecular Weight: | 165.66 |
Molecular Formula: | C7H16ClNO |
Canonical SMILES: | CC1(CCCNCC1)O.Cl |
InChI: | InChI=1S/C7H15NO.ClH/c1-7(9)3-2-5-8-6-4-7;/h8-9H,2-6H2,1H3;1H |
InChI Key: | WXKBXRNNRPFFKO-UHFFFAOYSA-N |
MDL: | MFCD21362373 |
LogP: | 1.64170 |
Publication Number | Title | Priority Date |
AU-2012314518-A1 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20110927 |
AU-2012314518-B2 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20110927 |
CA-2845191-A1 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20110927 |
CN-103987707-A | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20110927 |
EP-2760857-A1 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20110927 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.0920418 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.0920418 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 32.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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