Basic information
- Standard SMILES
FC(F)(F)C(F)(F)CBr- InChIKey
HKAWJXVJGNTQMW-UHFFFAOYSA-N- Molecular formula
- C3H2BrF5
- Average molar mass
- 212.94 g/mol
- Monoisotopic mass
- 211.92600326
Names & identifiers
- Preferred name
- Propane, 3-bromo-1,1,1,2,2-pentafluoro-
- IUPAC
- 3-bromo-1,1,1,2,2-pentafluoropropane
- English name
- 3-BroMo-1,1,1,2,2-pentafluoropropane
- Molecular formula
- C3H2BrF5
- Molecular weight
- 212.94
Names & synonyms
3-Bromo-1,1,1,2,2-pentafluoropropane422-01-5BRN 1743134Propane, 3-bromo-1,1,1,2,2-pentafluoro-2,2,3,3,3-Pentafluoropropyl bromideDTXSID401950254-01-00-00211 (Beilstein Handbook Reference)RefChem:374292DTXCID50117516C3H2BrF5MFCD00233030bromo-pentafluoropropane
Show more names
SCHEMBL1019090SCHEMBL1019091AKOS007930078AS-324433-bromo-1,1,1,2,2-pentafluoro-propaneDB-3151401-bromo-2,2,3,3,3-pentafluoro-n-propaneNS00121954
Database identifiers
- CAS
422-01-5- PubChem CID
- 67904
- DTXSID
DTXSID40195025- EC Number
- 873-216-3
- Nikkaji
- J1.348.864I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 94.9
Physicochemical properties
- Boiling point
- 46.5 °C · 46.5 °C
- Density
- 1.8217 · 1.8217 (rough estimate)
- refractive index
- 1.482 · 1.4820 (estimate)
- form
- liquid
- color
- Clear, colourless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280
- HS Code
- 2903793090 · 2903793090
- Toxicity
- 3 pph/6M · LC ihl-mus: >3 pph/6M ANASAB 17,337,62
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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.
Safety data
- hs_code
- 2903793090
- Toxicity
- LC ihl-mus: >3 pph/6M ANASAB 17,337,62
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280
Chemistry & industry
Suppliers8 total
常州新氟化学有限公司13275212658 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
Accela ChemBio Inc.+1(858) 699-3322 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
中科双航化学（大连）有限公司+86-411-66858498 13941194417 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
Related reactions
2 records
Linked notes
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