Basic information
- CAS
290297-43-7- Standard SMILES
CNC(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1- InChIKey
ZHIAARPZLAPMHX-UHFFFAOYSA-N- Molecular formula
- C11H11F6N
- Average molar mass
- 271.2 g/mol
- Monoisotopic mass
- 271.07956867
Names & identifiers
- Preferred name
- 3,5-Bis(trifluoromethyl)-alpha,N-dimethylbenzylamine
- IUPAC
- 1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine
- English name
- N-Methyl-1-[3,5-bis(trifluoomethyl)phenyl]ethylamine
- Molecular formula
- C11H11F6N
- Molecular weight
- 271.2
Names & synonyms
3,5-Bis(trifluoromethyl)-alpha,N-dimethylbenzylamine[1-[3,5-Bis(trifluoromethyl)phenyl]ethyl]methylamine(1-(3,5-Bis(trifluoromethyl)phenyl)ethyl)methylamineRefChem:486547813-731-2290297-43-71-(3,5-Bis(trifluoromethyl)phenyl)-N-methylethanamine1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamineMFCD084604991-(3,5-bis(trifluoromethyl)phenyl)-N-methylethan-1-amineC11H11F6N(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]-N-methylethanamine
Show more names
1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROPYLAMINEN-METHYL-1-[3,5-BIS(TRIFLUOOMETHYL)PHENYL]ETHYLAMINEBenzenemethanamine, N,α-dimethyl-3,5-bis(trifluoromethyl)-N-{1-[3,5-Bis-(trifluoromethyl)-phenyl]-ethyl}-methylamine(RS)-N-(1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHYL)METHYLAMINE1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-N-METHYLETHANAMINE(WXG03145)
1-[3,5-Bis(trifluoromethyl)phenyl]-N-methylethan-1-amine(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamineN-Methyl-1-[3,5-bis(trifluoromethyl)phenyl]ethylamineSCHEMBL14329061-(3,5-Bis(trifluoromethyl)-phenyl)-N-methylethanamine1-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-ethanamineDTXSID60621553AKOS010956726
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- Boiling point
- 172.9 · 172.9±35.0 °C(Predicted)
- Density
- 1.259 · 1.259±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 8.93 · 8.93±0.10(Predicted)
- form
- liquid
- color
- Clear
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280
- HS Code
- 2921490090 · 2921490090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
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, P317, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2921490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280
Chemistry & industry
Suppliers21 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13917420128 13062833949 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
武汉福鑫化工有限公司027-59207852 13308628970 · [email protected]
北京蓝博中兴科技有限公司010-56330744 15210344275 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
5 records
Compound notes
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