Basic information
- CAS
126063-08-9- Standard SMILES
O=C(Nc1ccc(I)cc1)C(F)(F)F- InChIKey
FDWUACCNDXQZBU-UHFFFAOYSA-N- Molecular formula
- C8H5F3INO
- Average molar mass
- 315.03 g/mol
- Monoisotopic mass
- 314.9368
Names & identifiers
- Preferred name
- 2,2,2-trifluoro-N-(4-iodophenyl)acetamide
- IUPAC
- 2,2,2-trifluoro-N-(4-iodophenyl)acetamide
- English name
- AcetaMide, 2,2,2-trifluoro-N-(4-iodophenyl)-
- Molecular formula
- C8H5F3INO
- Molecular weight
- 315.03
Names & synonyms
2,2,2-trifluoro-N-(4-iodophenyl)acetamide126063-08-9DTXSID70350726RefChem:242532DTXCID70301793Acetamide, 2,2,2-trifluoro-N-(4-iodophenyl)-MFCD004625634-IodotrifluoroacetanilideSCHEMBL1310823STK060933AKOS000490117ST035409
Show more names
N‐trifluoroacetyl‐4‐iodoaniline
CS-03246482,2,2-trifluoro-N-(4-iodo-phenyl)-acetamideG65032AE-848/0751904712R-1129
Database identifiers
- CAS
126063-08-9- PubChem CID
- 686962
- DTXSID
DTXSID70350726- Nikkaji
- J323.615C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 211
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers7 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
山东宜仁药业有限公司531-87922518 15628888630 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
上海芸联医药科技有限公司13120563767 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
13 records
Compound notes
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