2-(2,4-Difluorophenyl)ethan-1-amine
Basic information
- CAS
134672-72-3- Standard SMILES
NCCc1ccc(F)cc1F- InChIKey
OGCUAECIKFVXQG-UHFFFAOYSA-N- Molecular formula
- C8H9F2N
- Average molar mass
- 157.16 g/mol
- Monoisotopic mass
- 157.07030562
Names & identifiers
- Preferred name
- 2-(2,4-Difluorophenyl)ethan-1-amine
- IUPAC
- 2-(2,4-difluorophenyl)ethanamine
- English name
- Benzeneethanamine, 2,4-difluoro- (9CI)
- Molecular formula
- C8H9F2N
- Molecular weight
- 157.16
Names & synonyms
2-(2,4-difluorophenyl)ethan-1-amineRefChem:451985620-841-22-(2,4-difluorophenyl)ethanamine134672-72-32,4-Difluorophenethylamine2-(2,4-Difluorophenyl)ethylamineBenzeneethanamine, 2,4-difluoro- (9CI)MFCD015298782,4-Difluoro-benzeneethanamineBenzeneethanamine, 2,4-difluoro-SCHEMBL1116576
Show more names
2,4-Difluorophenethylamine97%2,4-DIFLUOROPHENETHYLAMINE 97%Benzeneethanamine,2,4-difluoro-
SCHEMBL294318342-(24-Difluorophenyl)ethanamineDTXSID60395080OGCUAECIKFVXQG-UHFFFAOYSA-NAKOS000148723AB92935CS-W021377FD80543
Database identifiers
- CAS
134672-72-3- PubChem CID
- 3689239
- DTXSID
DTXSID60395080- EC Number
- 620-841-2
- Nikkaji
- J1.463.038D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Boiling point
- 197 ℃ · 197℃
- Density
- 1.169 · 1.169
- Flash point
- 87 ℃ · 87℃
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 9.41 · 9.41±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
- RIDADR
- 2735 · 2735
- HazardClass
- 8 · 8
- PackingGroup
- Ⅲ
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
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
Danger
H302 (98.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 68 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (98.5%)
Safety data
- ridadr
- 2735
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- 8
- packing_group
- Ⅲ
- Hazard statements
- H302-H315-H319-H332-H335
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P261-P280-P305+P351+P338
Suppliers
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Related reactions
4 records
Compound notes
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