Ethyl 2-bromo-(4-bromophenyl)acetate - CAS 77143-76-1
Catalog: |
BB035815 |
Product Name: |
Ethyl 2-bromo-(4-bromophenyl)acetate |
CAS: |
77143-76-1 |
Synonyms: |
ethyl 2-bromo-2-(4-bromophenyl)acetate |
IUPAC Name: | ethyl 2-bromo-2-(4-bromophenyl)acetate |
Description: | Ethyl 2-bromo-(4-bromophenyl)acetate (CAS# 77143-76-1) is a useful research chemical. |
Molecular Weight: | 321.99 |
Molecular Formula: | C10H10Br2O2 |
Canonical SMILES: | CCOC(=O)C(C1=CC=C(C=C1)Br)Br |
InChI: | InChI=1S/C10H10Br2O2/c1-2-14-10(13)9(12)7-3-5-8(11)6-4-7/h3-6,9H,2H2,1H3 |
InChI Key: | PPRAWWBOUOBAON-UHFFFAOYSA-N |
Boiling Point: | 140 °C / 5 mmHg (lit.) |
Density: | 1.642 g/cm3 |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD09953497 |
LogP: | 3.44820 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2019127365-A1 | Inhibitors of hepatitis c virus replication | 20171101 |
WO-2016109501-A1 | Amide compounds as tryptophan hydroxylase inhibitors | 20141230 |
US-2015266875-A1 | Tyk2 inhibitors and uses thereof | 20140228 |
US-2016297826-A1 | Tyk2 inhibitors and uses thereof | 20140228 |
US-2017247373-A1 | Tyk2 inhibitors and uses thereof | 20140228 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 321.90271 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 319.90475 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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