2-Bromo-4'-methylpropiophenone - CAS 1451-82-7
Catalog: |
BB009898 |
Product Name: |
2-Bromo-4'-methylpropiophenone |
CAS: |
1451-82-7 |
Synonyms: |
2-bromo-1-(4-methylphenyl)-1-propanone; 2-bromo-1-(4-methylphenyl)propan-1-one |
IUPAC Name: | 2-bromo-1-(4-methylphenyl)propan-1-one |
Description: | 2-Bromo-4'-methylpropiophenone (CAS# 1451-82-7) is a compound useful in organic synthesis. |
Molecular Weight: | 227.10 |
Molecular Formula: | C10H11BrO |
Canonical SMILES: | CC1=CC=C(C=C1)C(=O)C(C)Br |
InChI: | InChI=1S/C10H11BrO/c1-7-3-5-9(6-4-7)10(12)8(2)11/h3-6,8H,1-2H3 |
InChI Key: | OZLUPIIIHOOPNQ-UHFFFAOYSA-N |
Boiling Point: | 273 ℃ |
Melting Point: | 75-77ºC |
Flash Point: | 59ºC |
Density: | 1.357 g/cm3 |
Appearance: | Off-white solid |
MDL: | MFCD11131402 |
LogP: | 2.96110 |
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-111377814-A | Preparation method of α -acyloxyketone compound | 20200310 |
EP-3838967-A1 | Immobilization of phenolic compounds | 20191216 |
WO-2021122859-A1 | Immobilization of phenolic compounds | 20191216 |
CN-108863740-B | Preparation method of naphthalenone compound | 20180613 |
US-2020348320-A1 | Cathinone test | 20171115 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.99933 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.99933 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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