N-Cyclobutylideneisopropylamine - CAS 823-10-9
Catalog: |
BB068955 |
Product Name: |
N-Cyclobutylideneisopropylamine |
CAS: |
823-10-9 |
Synonyms: |
N-Cyclobutylidene-1-methylethylamine; N-Cyclobutylidene-2-propanamine |
IUPAC Name: | N-propan-2-ylcyclobutanimine |
Description: | N-Cyclobutylideneisopropylamine is an intermediate in the synthesis of semisquaric acid derivatives. |
Molecular Weight: | 111.18 |
Molecular Formula: | C7H13N |
Canonical SMILES: | CC(C)N=C1CCC1 |
InChI: | InChI=1S/C7H13N/c1-6(2)8-7-4-3-5-7/h6H,3-5H2,1-2H3 |
InChI Key: | VJYSMYPFLNSTBK-UHFFFAOYSA-N |
Solubility: | DCM, Diethyl Ether |
Appearance: | Orange Oil |
Storage: | -20°C Freezer, Under inert atmosphere |
References: | Logothetis, A. L., et al. J. Am. Chem. Soc., 87, 749 (1965); Verniest, G., et al. J. Org. Chem., 70, 4549 (2005). |
Complexity: | 97 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 111.104799419 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 111.104799419 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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