Basic information
- CAS
2365-80-2- Standard SMILES
NC(CCC(F)(F)F)C(=O)O- InChIKey
KTZZIDWVKLDWBF-UHFFFAOYSA-N- Molecular formula
- C5H8F3NO2
- Average molar mass
- 171.12 g/mol
- Monoisotopic mass
- 171.05071298
Names & identifiers
- Preferred name
- 5,5,5-Trifluoro-DL-norvaline
- IUPAC
- 2-amino-5,5,5-trifluoropentanoic acid
- English name
- 2-Amino-5,5,5-trifluoropentanoic acid, 2-Amino-5,5,5-trifluorovaleric acid
- Molecular formula
- C5H8F3NO2
- Molecular weight
- 171.12
Names & synonyms
5,5,5-Trifluoro-DL-norvalineRefChem:527666807-066-75,5,5-trifluoronorvaline2-amino-5,5,5-trifluoropentanoic acid2365-80-223809-57-6MFCD001906482-Amino-5,5,5-trifluoro-pentanoic acidNSC76293SCHEMBL310317DTXSID90950040
Show more names
Norvaline, 5,5,5-trifluoro-5,5,5-Trifluoro-DL-norvaline96%5,5,5-Trifluoro-DL-norvaline 96%2-Amino-5,5,5-trifluoropentanoic acid, 2-Amino-5,5,5-trifluorovaleric acid
KTZZIDWVKLDWBF-UHFFFAOYSA-NHMS1661P02NSC-76293SBB0884722-amino-5,5,5-trifluoropentanoicacidAKOS005063402HY-W073738DA-66191
Database identifiers
- CAS
2365-80-2- PubChem CID
- 253377
- DTXSID
DTXSID90950040- EC Number
- 807-066-7
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 145
Physicochemical properties
- Melting point
- 254 · 254-256 °C
- Boiling point
- 206.7 · 206.7±40.0 °C(Predicted)
- Density
- 1.356 · 1.356±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 2.17 · 2.17±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2922498590 · 2922498590
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (50%)；Eye Irrit. 2 (50%)；STOT SE 3 (50%)
Safety data
- hs_code
- 2922498590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Related reactions
3 records
Compound notes
Loading…