1,2,3,6-Tetrahydro-4-methylpyridine - CAS 694-50-8
Catalog: |
BB057456 |
Product Name: |
1,2,3,6-Tetrahydro-4-methylpyridine |
CAS: |
694-50-8 |
Synonyms: |
1,2,3,6-Tetrahydro-4-picoline4-Methyl-1,2,3,6-tetrahydropyridine4-Methyl-1,2,5,6-tetrahydropyridine |
IUPAC Name: | 4-methyl-1,2,3,6-tetrahydropyridine |
Molecular Weight: | 97.16 |
Molecular Formula: | C6H11N |
Canonical SMILES: | CC1=CCNCC1 |
InChI: | InChI=1S/C6H11N/c1-6-2-4-7-5-3-6/h2,7H,3-5H2,1H3 |
InChI Key: | IZGVOANXLNJMDM-UHFFFAOYSA-N |
Complexity: | 84.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 97.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 97.089149355 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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