Propiophenone, 4-bromo-2-hydroxy-

HCID 140282
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Basic information

CAS
17764-92-0
Standard SMILES
CCC(=O)c1ccc(Br)cc1O
InChIKey
CPZPNEVIZAJTDT-UHFFFAOYSA-N
Molecular formula
C9H9BrO2
Average molar mass
229.07 g/mol
Monoisotopic mass
227.97859

Names & identifiers

Preferred name
Propiophenone, 4-bromo-2-hydroxy-
IUPAC
1-(4-bromo-2-hydroxyphenyl)propan-1-one
English name
1-(4-BROMO-2-HYDROXYPHENYL)-1-PROPANONE
Molecular formula
C9H9BrO2
Molecular weight
229.07

Names & synonyms

17764-92-0Propiophenone, 4-bromo-2-hydroxy-DTXSID80170356RefChem:375501DTXCID80928471-(4-bromo-2-hydroxyphenyl)propan-1-one1-(4-bromo-2-hydroxyphenyl)-1-propanone1-Propanone, 1-(4-bromo-2-hydroxyphenyl)-MFCD03791251SCHEMBL7534898SCHEMBL30863507CPZPNEVIZAJTDT-UHFFFAOYSA-N
Show more names
Propiophenone, 4-bromo-2-hydroxy-,SBB097396AKOS005071335Propiophenone, 4'-bromo-2'-hydroxy-1-(4-bromo-2-hydroxy-phenyl)-propan-1-oneCS-03184119T-0062

Database identifiers

CAS
17764-92-0
PubChem CID
140282
DTXSID
DTXSID80170356

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12

Physicochemical properties

Melting point
48 · 48-49°C
Boiling point
156 · 156-158 °C(Press: 17 Torr)
Density
1.506 · 1.506±0.06 g/cm3(Predicted)
pka
7.28 · 7.28±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
2914790090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Applications

Uses1-(4-Bromo-2-hydroxyphenyl)-1-propanone is a useful compound for preparation of indazoles.

Preparation methods · 1 item

PreparationPreparation by Friedel–Crafts acylation of m-bromophenol with propionyl chloride in the presence of aluminium chloride in refluxing ethylene dichloride for 2 h (78%)Also obtained by Fries rearrangement of 3-bromophenyl propionate in the presence of aluminium chloride at 50° for 3 h (47%).

Suppliers8 total

武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海堃泽医药科技有限公司021-68712331 3286104197

Related reactions

2 records
New reaction record

Compound notes

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