2-Amino-5-chlorphenol

2-Amino-5-chlorophenol

HCID 91591CAS 28443-50-7

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Grundinformationen

Standard-SMILES: Nc1ccc(Cl)cc1O
InChIKey: FZCQMIRJCGWWCL-UHFFFAOYSA-N
Summenformel: C6H6ClNO
Durchschnittliche Molmasse: 143,57 g/mol
Monoisotopische Masse: 143,0137915

Namen und Bezeichner

Bevorzugter Name: 2-Amino-5-chlorophenol
IUPAC: 2-amino-5-chlorophenol
Lokaler Name: 2-Amino-5-chlorphenol
Englischer Name: 2-Amino-5-chlorophenol
Summenformel: C6H6ClNO
Molmasse: 143.57

Namen und Synonyme

2-Amino-5-chlorophenol28443-50-74-chloro-2-hydroxyanilinePhenol, 2-amino-5-chloro-5-chloro-2-aminophenol6VK2H53LQNDTXSID6067385CHEBI:75051RefChem:85263DTXCID0037819249-020-3MFCD02093863

Weitere Namen anzeigen

TIMTEC-BB SBB0041372-Amino-5-chlorophenCyclohexane Impurity 1Lenvatinib Impurity 82Chlorzoxazone Impurity 242-Amino-5-chlorophenol 97%2-Amino-5-chlorophenol,99%

2-amino-5-chloro-phenolEINECS 249-020-35-chloro-o-aminophenol2-hydroxy-4-chloroanilineUNII-6VK2H53LQNEC 249-020-3SCHEMBL1033293-CHLORO-6-AMINOPHENOL

Datenbank-Bezeichner

CAS: 28443-50-7
PubChem CID: 91591
DTXSID: DTXSID6067385
ChEBI: CHEBI:75051
UNII: 6VK2H53LQN
EC Number: 249-020-3
Nikkaji: J88.559B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 46,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 99

Physikochemische Eigenschaften

Schmelzpunkt: 145 · 145-153 °C (lit.)
Siedepunkt: 185.5 °C · 185.5°C (rough estimate)
Dichte: 1.2028 · 1.2028 (rough estimate)
Dampfdruck: 0.002 · 0.002-0.094Pa at 20-50℃
Brechungsindex: 1.5618 · 1.5618 (estimate)
storage temp.: -20 °C, · -20°C, stored under nitrogen
Löslichkeit: soluble in Methanol
pka: 8.79 · 8.79±0.10(Predicted)
Aggregatzustand: Powder
Farbe: Light brown
InChI: InChI=1S/C6H6ClNO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2
InChIKey: FZCQMIRJCGWWCL-UHFFFAOYSA-N
SMILES: C1(O)=CC(Cl)=CC=C1N
CAS Datenbank: 28443 · 28443-50-7(CAS DataBase Reference)
EPA chemische Informationen: 2 · Phenol, 2-amino-5-chloro- (28443-50-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory InformationStatus: Cease Manufacture Update: 19-02-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/12346

Hazard Classes and CategoriesSkin Irrit. 2 (97.7%)；Eye Irrit. 2 (97.7%)；STOT SE 3 (95.3%)

Regulatorische Informationen

Regulatory InformationStatus: Cease Manufacture Update: 19-02-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/12346

Sicherheitsdaten

wgk: 3
tsca: TSCA listed
hs_code: 29222990
risk_code: 36/37/38-20/21/22
hazard_code: Xi,Xn
hazard_note: Irritant
safety_code: 26-36-36/37/39
hazard_class: 6.1
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationPhenol, 2-amino-5-chloro-: ACTIVE

Anwendungen

Verwenden2-Amino-5-chlorophenol may be used to synthesize 2-amino-5-chloromuconic semialdehyde and benzoxazole derivatives.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

4-Chlor-o-anisidin 2,6-Dichlorbenzoxazol 6-Chlorbenzoxazol-2(3H)-thion

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

上海达立康医药科技有限公司18658316824

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: Phenol carrying amino and chloro substituents at positions 2 and 5 respectively. It is part of the degradation pathway of 4-chloronitrobenzene, CHEBI:34399.