Basic information
- CAS
56915-87-8- Standard SMILES
CC(=O)c1cccc(NC(=O)C(F)(F)F)c1- InChIKey
QJIHIZOVLAWHFM-UHFFFAOYSA-N- Molecular formula
- C10H8F3NO2
- Average molar mass
- 231.17 g/mol
- Monoisotopic mass
- 231.05071316
Names & identifiers
- Preferred name
- Acetanilide, 3'-acetyl-2,2,2-trifluoro-
- IUPAC
- N-(3-acetylphenyl)-2,2,2-trifluoroacetamide
- English name
- TIMTEC-BB SBB000702
- Molecular formula
- C10H8F3NO2
- Molecular weight
- 231.17
Names & synonyms
56915-87-8Acetamide, N-(3-acetylphenyl)-2,2,2-trifluoro-BRN 3054640Acetanilide, 3'-acetyl-2,2,2-trifluoro-3'-Acetyl-2,2,2-trifluoroacetanilideDTXSID60205453RefChem:315771DTXCID60127944N-(3-acetylphenyl)-2,2,2-trifluoroacetamideMFCD01357093TIMTEC-BB SBB000702CBMicro_017507
Show more names
SBB000702EU-0037376CDS1_004003ZINC00035855
BIM-0017508.P001N-(3-acetylphenyl)-2,2,2-trifluoro-acetamideSSYDivK1c_005043SCHEMBL18753673-acetyl-trifluoroacetylaminobenzeneALBB-002859BBL014156
Database identifiers
- CAS
56915-87-8- PubChem CID
- 673706
- DTXSID
DTXSID60205453- EC Number
- 159-446-0
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 288
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers17 total
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
Related reactions
5 records
Compound notes
Loading…