Methyl 2-(3-Bromophenyl)-2-methylpropanoate - CAS 251458-15-8
Catalog: |
BB018761 |
Product Name: |
Methyl 2-(3-Bromophenyl)-2-methylpropanoate |
CAS: |
251458-15-8 |
Synonyms: |
2-(3-bromophenyl)-2-methylpropanoic acid methyl ester; methyl 2-(3-bromophenyl)-2-methylpropanoate |
IUPAC Name: | methyl 2-(3-bromophenyl)-2-methylpropanoate |
Description: | Methyl 2-(3-Bromophenyl)-2-methylpropanoate (CAS# 251458-15-8) is a useful research chemical. |
Molecular Weight: | 257.12 |
Molecular Formula: | C11H13BrO2 |
Canonical SMILES: | CC(C)(C1=CC(=CC=C1)Br)C(=O)OC |
InChI: | InChI=1S/C11H13BrO2/c1-11(2,10(13)14-3)8-5-4-6-9(12)7-8/h4-7H,1-3H3 |
InChI Key: | ZTBCOZQPDZZCJO-UHFFFAOYSA-N |
LogP: | 2.89970 |
Publication Number | Title | Priority Date |
WO-2021165245-A1 | Compounds | 20200218 |
WO-2021155316-A1 | Compounds and uses thereof | 20200129 |
KR-20210081286-A | Novel Amino Aryl Derivatives and Their Use as Inhibitors against Diacylglycerol Acyltransferase 2 | 20191223 |
WO-2021133035-A1 | Novel amino aryl derivative useful as diacylglycerol acyltransferase 2 inhibitor and use thereof | 20191223 |
WO-2021105960-A1 | Substituted tricyclic compounds | 20191129 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 256.00989 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.00989 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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