4,4'-Dichloro-[1,1'-biphenyl]-3-amine
Basic information
- CAS
1176472-35-7- Standard SMILES
Nc1cc(-c2ccc(Cl)cc2)ccc1Cl- InChIKey
ZOHUBFLTOCYQAL-UHFFFAOYSA-N- Molecular formula
- C12H9Cl2N
- Average molar mass
- 238.11 g/mol
- Monoisotopic mass
- 237.0112047
Names & identifiers
- Preferred name
- 4,4'-Dichloro-[1,1'-biphenyl]-3-amine
- IUPAC
- 2-chloro-5-(4-chlorophenyl)aniline
Names & synonyms
1176472-35-74,4'-Dichloro-[1,1'-biphenyl]-3-amine4,4'-dichloro-(1,1'-biphenyl)-3-amineRefChem:506627874-359-42-chloro-5-(4-chlorophenyl)anilineAKOS012206353EN300-4230718
Database identifiers
- CAS
1176472-35-7- PubChem CID
- 39232014
- EC Number
- 874-359-4
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 202
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, 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%)
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Related reactions
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Compound notes
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