β-Calacorene - CAS 50277-34-4
Catalog: |
BB070677 |
Product Name: |
β-Calacorene |
CAS: |
50277-34-4 |
Synonyms: |
beta-Calacorene; 4-Isopropyl-6-methyl-1-methylene-1,2,3,4-tetrahydronaphthalene; Isopropoxy(isopropyl)dimethylsilane; 7-methyl-4-methylidene-1-propan-2-yl-2,3-dihydro-1H-naphthalene; Naphthalene, 1,2,3,4-tetrahydro-6-methyl-1-methylene-4-(1-methylethyl)- |
IUPAC Name: | 7-methyl-4-methylidene-1-propan-2-yl-2,3-dihydro-1H-naphthalene |
Molecular Weight: | 200.33 |
Molecular Formula: | C15H20 |
Canonical SMILES: | CC1=CC2=C(C=C1)C(=C)CCC2C(C)C |
InChI: | InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,13H,4,6,8H2,1-3H3 |
InChI Key: | KFYISTOZYAKAPV-UHFFFAOYSA-N |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.156500638 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.156500638 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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