Basic information
- CAS
141-85-5- Standard SMILES
Cl.Nc1cccc(Cl)c1- InChIKey
NMGHWHCTRGZZOP-UHFFFAOYSA-N- Molecular formula
- C6H6ClN.ClH
- Average molar mass
- 164.03 g/mol
- Monoisotopic mass
- 162.99555458
Overview
3-Chloroaniline hydrochloride is a substituted aniline.
Names & identifiers
- Preferred name
- Benzenamine, 3-chloro-, hydrochloride (1:1)
- IUPAC
- 3-chloroaniline;hydrochloride
- English name
- 3-Chloroaniline hydrochloride
- Molecular formula
- C6H7Cl2N
- Molecular weight
- 164.03
Names & synonyms
Show more names
Database identifiers
- CAS
141-85-5- PubChem CID
- 67336
- DTXSID
DTXSID3059711- ChEBI
CHEBI:194680- UNII
- ER362HA9FV
- EC Number
- 205-506-7
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 74.9
Physicochemical properties
- Melting point
- 222 °C · 222°C (dec.)
- Colour Index
- 37005 · 37005
- form
- powder to crystal
- color
- White to Gray to Brown
- Water Solubility
- almost transparency
- BRN
- 3623168 · 3623168
- CAS DataBase Reference
- 141 · 141-85-5(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 362 HA9FV · ER362HA9FV
- EPA Substance Registry System
- 3 · 3-Chloroaniline hydrochloride (141-85-5)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301+H311+H331-H315-H319-H335
- Precautionary statements
- 501 · P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405
- Risk Statements
- 23 · 23/24/25-33-50/53
- Safety Statements
- 28 · 28-36/37-45-60-61
- RIDADR
- 2811 · 2811
- RTECS
- 1393800 · BX1393800
- TSCA
- TSCA listed
- HS Code
- 2921.42 · 2921.42.9000
- HazardClass
- 6.1 · 6.1
- PackingGroup
- III
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (90.9%): 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)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Benzenamine, 3-chloro-, hydrochloride
Benzenamine, 3-chloro-, hydrochloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- tsca
- TSCA listed
- rtecs
- BX1393800
- ridadr
- 2811
- hs_code
- 2921.42.9000
- risk_code
- 23/24/25-33-50/53
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- safety_code
- 28-36/37-45-60-61
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H301+H311+H331-H315-H319-H335
- Precautionary statements
- P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405
Chemistry & industry
Uses & manufacturing
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers35 total
Additional notes
DefinitionChEBI: 3-Chloroaniline hydrochloride is a substituted aniline.
Related reactions
Compound notes
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