Grundinformationen
- Standard-SMILES
Nc1cc(Cl)ccc1O- InChIKey
SWFNPENEBHAHEB-UHFFFAOYSA-N- Summenformel
- C6H6ClNO
- Durchschnittliche Molmasse
- 143,57 g/mol
- Monoisotopische Masse
- 143,01379149
Überblick
2-Amino-4-Chlorophenol can cause cancer according to California Labor Code.
Namen und Bezeichner
- Bevorzugter Name
- 2-Amino-4-chlorophenol
- IUPAC
- 2-amino-4-chlorophenol
- Lokaler Name
- 2-Amino-4-chlorphenol
- Englischer Name
- 2-Amino-4-chlorophenol
- Summenformel
- C6H6ClNO
- Molmasse
- 143.57
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
95-85-2- PubChem CID
- 7265
- DTXSID
DTXSID5024473- ChEMBL
CHEMBL251389- UNII
- 2Z43LEA3DX
- EC Number
- 202-458-9
- Nikkaji
- J31.070K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,8
- Polarare Oberfläche (TPSA)
- 46,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 99,1
Experimentelle und physikochemische Eigenschaften
Cosmetics
Cosmetic ingredients (4-Chloro-2-Aminophenol) -> CIR (Cosmetic Ingredient Review)
Hair dyeing
LogP
1.24
1.81
Solubility
less than 1 mg/mL at 68 °F (NTP, 1992)
Solubility in water, g/l at 26 °C: 3 (slightly soluble)
Melting Point
284 to 286 °F (decomposes) (NTP, 1992)
140 °C
Vapor Pressure
0.00141 [mmHg]
Vapor pressure, Pa at 25 °C: 0.2
Physical Description
2-Amino-4-chlorophenol is a light brown colored crystalline solid. It may be toxic by ingestion. It is insoluble in water. It is used to make other chemicals.
Brown solid; [ICSC] Brown powder; [Alfa Aesar MSDS]
BROWN CRYSTALLINE POWDER WITH CHARACTERISTIC ODOUR.
Physikochemische Eigenschaften
- Schmelzpunkt
- 136 · 136-141 °C(lit.)
- Siedepunkt
- 185.5 °C · 185.5°C (rough estimate)
- Dichte
- 1.2028 · 1.2028 (rough estimate)
- Brechungsindex
- 1.5618 · 1.5618 (estimate)
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- 2.3 g/l · 2.3g/l
- pka
- 9.31 · 9.31±0.18(Predicted)
- Aggregatzustand
- Solid
- Farbe
- Pale Orange to Light Brown
- Wasserlöslichkeit
- 0.1 g/100 · Insoluble. <0.1 g/100 mL at 20 ºC
- BRN
- 774859 · 774859
- Stabilität
- Stable. Incompatible with strong oxidizing agents.
- Kosmetik-Inhaltsstoffe Funktionen
- HAIR DYEING
- InChI
- 1S/C6H6ClNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
- InChIKey
- SWFNPENEBHAHEB-UHFFFAOYSA-N
- SMILES
- Nc1cc(Cl)ccc1O
- CAS Datenbank
- 95 · 95-85-2(CAS DataBase Reference)
- NIST chemische Informationen
- 5 · 5-Chloro-2-hydroxyaniline(95-85-2)
- EPA chemische Informationen
- 2 · 2-Amino-4-chlorophenol (95-85-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 15.5% (15 of 97) of reports.
Warning
H302 (84.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 97 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
Gefahrenhinweise
Regulatory Information
Chemical: Phenol, 2-amino-4-chloro-
Hazard Traits - Carcinogenicity
Status: Active Update: 23-11-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10289
4-Chloro-2-aminophenol: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire Hazards
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.
Combustible. Gives off irritating or toxic fumes (or gases) in a fire.
Health Hazards
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.
Sicherheit und Schutzausrüstung
Fire Fighting
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
Use water spray, foam, powder, carbon dioxide.
First Aid Measures
Fresh air, rest. Seek medical attention if you feel unwell.
Wear protective gloves when administering first aid. Remove contaminated clothes. Rinse and then wash skin with water and soap.
Rinse with plenty of water for several minutes (remove contact lenses if easily possible).
Rinse mouth. Refer for medical attention .
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
General First Aid:
Spillage Disposal
Personal protection: particulate filter respirator adapted to the airborne concentration of the substance, protective clothing and protective gloves. Sweep spilled substance into covered containers. If appropriate, moisten first to prevent dusting. Carefully collect remainder. Then store and dispose of according to local regulations.
Isolation and Evacuation
Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:
Immediate precautionary measure
Toxikologische Informationen
Toxicity Summary
The CIR Expert Panel concludes that the available data support the safety of 6-Amino-m-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol and 5-Amino-6-Chloro-o-Cresol as used in oxidative and nonoxidative (semipermanent) for dyes. The available data also support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol for use in oxidative hair dyes, but are insufficient to support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol and nonoxidative (semipermanent) hair dyes.
Safe for use in cosmetics, with qualifications
Signs and Symptoms
See Effects of short-term exposure.
Redness.
Redness.
Carcinogen Classification
2-Amino-4-chlorophenol
Group 2B: Possibly carcinogenic to humans
Volume 123: (2020) Some Nitrobenzenes and Other Industrial Chemicals
2020 online
2018
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2673
- hs_code
- 29222900
- RTECS-Nr.
- SJ5700000
- risk_code
- 22-36/37/38-20/21/22
- hazard_code
- Xn
- safety_code
- 26-36-36/37/39
- hazard_class
- 6.1
- packing_group
- II
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 4 OralCarc. 2
Chemie und Industrie
Verwendung und Herstellung
Uses
CIR ingredient: 4-Chloro-2-Aminophenol
Used as an intermediate; [NTP]
Anwendungen
VerwendenIntermediate.
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