4-Bromo-2,3-dimethyl-1-butene - CAS 58654-04-9
Catalog: |
BB074131 |
Product Name: |
4-Bromo-2,3-dimethyl-1-butene |
CAS: |
58654-04-9 |
Synonyms: |
4-Bromo-2,3-dimethylbut-1-ene; 1-Butene, 4-bromo-2,3-dimethyl- |
IUPAC Name: | 4-bromo-2,3-dimethylbut-1-ene |
Molecular Weight: | 163.06 |
Molecular Formula: | C6H11Br |
Canonical SMILES: | CC(CBr)C(=C)C |
InChI: | InChI=1S/C6H11Br/c1-5(2)6(3)4-7/h6H,1,4H2,2-3H3 |
InChI Key: | KHEGBTSWRVDATP-UHFFFAOYSA-N |
Complexity: | 66.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.00441 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.00441 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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