Ethyl p-(6-Bromohexyloxy)benzoate - CAS 73515-07-8
Catalog: |
BB065450 |
Product Name: |
Ethyl p-(6-Bromohexyloxy)benzoate |
CAS: |
73515-07-8 |
Synonyms: |
Ethyl 4-((6-bromohexyl)oxy)benzoate; Ethyl 4-(6-bromohexoxy)benzoate; ethyl 4-(6-bromohexyloxy)benzoate; 6-(4-carbethoxyphenoxy)hexyl bromide; 4-[(6-Bromohexyl)oxy]benzoic acid ethyl ester |
IUPAC Name: | ethyl 4-(6-bromohexoxy)benzoate |
Molecular Weight: | 329.23 |
Molecular Formula: | C15H21BrO3 |
Canonical SMILES: | CCOC(=O)C1=CC=C(C=C1)OCCCCCCBr |
InChI: | InChI=1S/C15H21BrO3/c1-2-18-15(17)13-7-9-14(10-8-13)19-12-6-4-3-5-11-16/h7-10H,2-6,11-12H2,1H3 |
InChI Key: | QLQZHOCCTBIRPH-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: | 328.06741 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 328.06741 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.2 |
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