Basic information
- CAS
103935-48-4- Standard SMILES
O=S(=O)(OCCCBr)C(F)(F)F- InChIKey
SEAVCWYCBPZIEO-UHFFFAOYSA-N- Molecular formula
- C4H6BrF3O3S
- Average molar mass
- 271.06 g/mol
- Monoisotopic mass
- 269.91731181
Overview
reagent for radiolabeling of amines
Names & identifiers
- Preferred name
- 3-Bromopropyl 1,1,1-trifluoromethanesulfonate
- IUPAC
- 3-bromopropyl trifluoromethanesulfonate
- English name
- 3-bromopropyl-1-trifluoromethanesulfonate
- Molecular formula
- C4H6BrF3O3S
- Molecular weight
- 271.05
Names & synonyms
103935-48-43-Bromopropyl-1-trifluoromethanesulfonate3-Bromopropyl-1-triflateDTXSID501461493-Bromopropyl 1,1,1-trifluoromethanesulfonateRefChem:911211DTXCID60686403-bromopropyl trifluoromethanesulfonate3-bromopropyl triflateC4H6BrF3O3SSCHEMBL11183533-bromopropyltrifluoromethanesulfonate
Show more names
Methanesulfonic acid, 1,1,1-trifluoro-, 3-bromopropyl ester
MFCD27941109AT33803trifluoromethanesulfonic acid 3-bromo-propyl estertrifluoro-methanesulfonic acid 3-bromo-propyl esterMethanesulfonic acid, trifluoro-, 3-bromopropyl ester
Database identifiers
- CAS
103935-48-4- PubChem CID
- 124865
- DTXSID
DTXSID50146149
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 217
Chemistry & industry
Suppliers5 total
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
Related reactions
1 records
Compound notes
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