2-(4-Bromophenyl)-2-(isobutyryloxy)acetic Acid - CAS 1385694-70-1
Catalog: |
BB008805 |
Product Name: |
2-(4-Bromophenyl)-2-(isobutyryloxy)acetic Acid |
CAS: |
1385694-70-1 |
Synonyms: |
2-(4-bromophenyl)-2-(2-methyl-1-oxopropoxy)acetic acid; 2-(4-bromophenyl)-2-(2-methylpropanoyloxy)acetic acid |
IUPAC Name: | 2-(4-bromophenyl)-2-(2-methylpropanoyloxy)acetic acid |
Description: | 2-(4-Bromophenyl)-2-(isobutyryloxy)acetic Acid (CAS# 1385694-70-1) is a useful research chemical. |
Molecular Weight: | 301.13 |
Molecular Formula: | C12H13BrO4 |
Canonical SMILES: | CC(C)C(=O)OC(C1=CC=C(C=C1)Br)C(=O)O |
InChI: | InChI=1S/C12H13BrO4/c1-7(2)12(16)17-10(11(14)15)8-3-5-9(13)6-4-8/h3-7,10H,1-2H3,(H,14,15) |
InChI Key: | RWHIJSKRSRZFNL-UHFFFAOYSA-N |
LogP: | 3.74160 |
Publication Number | Title | Priority Date |
CN-111146496-A | Polymer electrolyte and lithium ion battery containing same | 20191223 |
CN-111162313-A | Polymer electrolyte and lithium ion battery | 20191223 |
CN-111146496-B | Polymer electrolyte and lithium ion battery containing same | 20191223 |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.99972 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.99972 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 63.6 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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