2,3,5-Trichloroaniline
Basic information
- CAS
18487-39-3- Standard SMILES
Nc1cc(Cl)cc(Cl)c1Cl- InChIKey
MOTBXEPLFOLWHZ-UHFFFAOYSA-N- Molecular formula
- C6H4Cl3N
- Average molar mass
- 196.5 g/mol
- Monoisotopic mass
- 194.940932
Names & identifiers
- Preferred name
- 2,3,5-Trichloroaniline
- IUPAC
- 2,3,5-trichloroaniline
- English name
- 2,3,5-trichloroaniline
- Molecular formula
- C6H4Cl3N
- Molecular weight
- 196.46
Names & synonyms
2,3,5-TrichloroanilineBenzenamine, 2,3,5-trichloro-2,3,5-TrichlorobenzenamineEINECS 242-373-4DTXSID40171667RefChem:81395DTXCID0094158242-373-418487-39-3MFCD04114058trichloroaniline7D27GT9JNH
Show more names
2,3,5-Trichloroaniline 100 μg/ml Methanol2,3,5-Trichloroaniline 100 μg/mL in Acetonitrile
2,3,5-Trichloroaniline; Aniline, 2,3,5-trichloro- (6CI,8CI); 2,3,5-Trichlorobenzenamine2,3,5-TrichloranilinUNII-7D27GT9JNHSCHEMBL3161558AKOS006294647DS-10256SY116267CS-0060180
Database identifiers
- CAS
18487-39-3- PubChem CID
- 87676
- DTXSID
DTXSID40171667- UNII
- 7D27GT9JNH
- EC Number
- 242-373-4
- Nikkaji
- J222.217E
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Melting point
- 73 °C · 73 °C
- Boiling point
- 286 · 286.0±35.0 °C(Predicted)
- Density
- 1.54 · 1.540±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 0.54 · 0.54±0.10(Predicted)
- color
- Light Brown to Brown
- FDA UNII
- 7 D27GT9JNH · 7D27GT9JNH
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
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Related reactions
4 records
Compound notes
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