1-Bromo-2-chloro-4,5-methylenedioxybenzene - CAS 233770-05-3
Catalog: |
BB071820 |
Product Name: |
1-Bromo-2-chloro-4,5-methylenedioxybenzene |
CAS: |
233770-05-3 |
Synonyms: |
5-Bromo-6-chlorobenzo[d][1,3]dioxole; 1-Bromo-2-chloro-4,5-methylenedioxybenzene; 5-bromo-6-chloro-1,3-benzodioxole; 1,3-Benzodioxole, 5-bromo-6-chloro-; 5-bromo-6-chloro-1,3-dioxaindane |
IUPAC Name: | 5-bromo-6-chloro-1,3-benzodioxole |
Description: | 1-Bromo-2-chloro-4,5-methylenedioxybenzene |
Molecular Weight: | 235.46 |
Molecular Formula: | C7H4BrClO2 |
Canonical SMILES: | C1OC2=CC(=C(C=C2O1)Br)Cl |
InChI: | InChI=1S/C7H4BrClO2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2 |
InChI Key: | VNFIRXCKAFPWRQ-UHFFFAOYSA-N |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.90832 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.90832 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 18.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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