2-(3,4-Dimethoxyphenyl)azetidine Hydrochloride - CAS 1346599-29-8
Catalog: |
BB067124 |
Product Name: |
2-(3,4-Dimethoxyphenyl)azetidine Hydrochloride |
CAS: |
1346599-29-8 |
Synonyms: |
2-(3,4-Dimethoxyphenyl)azetidine hydrochloride |
IUPAC Name: | 2-(3,4-dimethoxyphenyl)azetidinehydrochloride |
Description: | A 2-aryl substituted Azetidine (A813000). |
Molecular Weight: | 229.7 |
Molecular Formula: | C11H16ClNO2 |
Canonical SMILES: | COC1=C(C=C(C=C1)C2CCN2)OC.Cl |
InChI: | InChI=1S/C11H15NO2.ClH/c1-13-10-4-3-8(7-11(10)14-2)9-5-6-12-9/h3-4,7,9,12H,5-6H2,1-2H31H |
InChI Key: | POWVLNOUHHIPEL-UHFFFAOYSA-N |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.0869564 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.0869564 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 30.5Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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