Basic information
- CAS
6134-79-8- Standard SMILES
CC(=NO)c1ccc(O)cc1O- InChIKey
FQPRUMXSHZSJGM-UHFFFAOYSA-N- Molecular formula
- C8H9NO3
- Average molar mass
- 167.16 g/mol
- Monoisotopic mass
- 167.05824315
Names & identifiers
- Preferred name
- 2',4'-Dihydroxyacetophenone oxime
- IUPAC
- 4-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol
- English name
- 2,4-Dihydroxyacetophenone oxime
- Molecular formula
- C8H9NO3
- Molecular weight
- 167.16
Names & synonyms
6134-79-81-(2,4-Dihydroxyphenyl)ethanone oxime(1E)-1-(2,4-Dihydroxyphenyl)ethanone oxime2',4'-Dihydroxyacetophenone oxime1-(2,4-Dihydroxy-phenyl)-ethanone oximeChemDiv3_010983Oprea1_513937SCHEMBL1656388FQPRUMXSHZSJGM-UHFFFAOYSA-NYEPXEBVOHXUWIY-FNORWQNLSA-N2,4-DIHYDROXYACETOPHENONEOXIME3-hydroxy-4-[1-(hydroxyamino)ethylidene]cyclohexa-2,5-dien-1-one
Show more names
RESACETOPHENONE OXIME2,4-Dihydroxyacetophenone oxime1-(2,4-Dihydroxyphenyl)ethan-1-one oximeEthanone, 1-(2,4-dihydroxyphenyl)-, oxime4-[1-(Hydroxyimino)ethyl]benzene-1,3-diol(Z)-1-(2,4-dihydroxyphenyl)ethan-1-one oxime
Database identifiers
- CAS
6134-79-8- PubChem CID
- 345168
- EC Number
- 104-463-0
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Melting point
- 202 · 202-203 °C
- Boiling point
- 384.426 · 384.426±12.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.301 · 1.301±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 8.29 · 8.290±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers16 total
上海景颜化工科技有限公司13817811078 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]
上海宣月科技有限公司15216675652 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海源叶生物科技有限公司13636370518 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
上海索本生物科技有限公司15088289376;13917786310 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
Related reactions
9 records
Compound notes
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