3,5-Dimethyl-2-phenylmorpholine - CAS 1218345-44-8
Catalog: |
BB073137 |
Product Name: |
3,5-Dimethyl-2-phenylmorpholine |
CAS: |
1218345-44-8 |
Synonyms: |
3,5-dimethyl-2-phenylmorpholine; 5-Methylphenmetrazine; 5-Mpm; PDM-35; 2-Phenyl-3,5-dimethylmorpholine; Morpholine, 3,5-dimethyl-2-phenyl- |
IUPAC Name: | 3,5-dimethyl-2-phenylmorpholine |
Molecular Weight: | 191.26 |
Molecular Formula: | C12H17NO |
Canonical SMILES: | CC1COC(C(N1)C)C2=CC=CC=C2 |
InChI: | InChI=1S/C12H17NO/c1-9-8-14-12(10(2)13-9)11-6-4-3-5-7-11/h3-7,9-10,12-13H,8H2,1-2H3 |
InChI Key: | YKCSYIYQRSVLAK-UHFFFAOYSA-N |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.131014166 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.131014166 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 21.3Ų |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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