2-Fluoro-4-(propan-2-yl)aniline
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Basic information
- CAS
87119-12-8- Standard SMILES
CC(C)c1ccc(N)c(F)c1- InChIKey
UHLWQRYLMMKFRU-UHFFFAOYSA-N- Molecular formula
- C9H12FN
- Average molar mass
- 153.2 g/mol
- Monoisotopic mass
- 153.09537755
Names & identifiers
- Preferred name
- 2-Fluoro-4-(propan-2-yl)aniline
- IUPAC
- 2-fluoro-4-propan-2-ylaniline
- English name
- 2-FLUORO-4-ISOPROPYLANILINE
- Molecular formula
- C9H12FN
- Molecular weight
- 153.2
Names & synonyms
87119-12-82-Fluoro-4-(propan-2-yl)anilineDTXSID10601688RefChem:260911DTXCID70552445820-513-02-FLUORO-4-ISOPROPYLANILINEMFCD082752992-fluoro-4-propan-2-ylaniline2-fluoro-4-isopropyl-anilineSCHEMBL4826032GS2641
Show more names
Benzenamine, 2-fluoro-4-(1-methylethyl)-Benzenamine, 2-fluoro-4-(1-methylethyl)- (9CI)
AKOS013203820SY399175F95558EN300-1692342
Database identifiers
- CAS
87119-12-8- PubChem CID
- 19986945
- DTXSID
DTXSID10601688- EC Number
- 820-513-0
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332-H315-H319-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
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)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H312-H332-H315-H319-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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