3'-Bromo-2'-methoxyacetophenone - CAS 267651-23-0
Catalog: |
BB019359 |
Product Name: |
3'-Bromo-2'-methoxyacetophenone |
CAS: |
267651-23-0 |
Synonyms: |
1-(3-bromo-2-methoxyphenyl)ethanone; 1-(3-bromo-2-methoxyphenyl)ethanone |
IUPAC Name: | 1-(3-bromo-2-methoxyphenyl)ethanone |
Description: | 3'-Bromo-2'-methoxyacetophenone (CAS# 267651-23-0) is used as a reagent in the preparation of Tyrosine-Derived Benzofuranones. |
Molecular Weight: | 229.07 |
Molecular Formula: | C9H9BrO2 |
Canonical SMILES: | CC(=O)C1=C(C(=CC=C1)Br)OC |
InChI: | InChI=1S/C9H9BrO2/c1-6(11)7-4-3-5-8(10)9(7)12-2/h3-5H,1-2H3 |
InChI Key: | IBHCVANJIBGASI-UHFFFAOYSA-N |
LogP: | 2.66030 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112852769-A | Method for preparing (S) -1- (2-methoxy-3-bromophenyl) ethanol | 20200814 |
CN-112852769-B | Method for preparing (S) -1- (2-methoxy-3-bromophenyl) ethanol | 20200814 |
US-2021188857-A1 | Sos1 inhibitors | 20191220 |
WO-2015050471-A1 | Carbazole compounds and methods of using same | 20131002 |
WO-2015050472-A1 | Fused indole compounds and methods of using same | 20131002 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.97859 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.97859 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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