CAS 5930-28-9 4-Amino-2,6-dichlorophenol (HCID 80037)

Names & identifiers

Preferred name: 4-Amino-2,6-dichlorophenol
IUPAC: 4-amino-2,6-dichlorophenol
English name: 4-Amino-2,6-dichlorophenol
Molecular formula: C6H5Cl2NO
Molecular weight: 178.02

Names & synonyms

4-Amino-2,6-dichlorophenol5930-28-92,6-Dichloro-4-aminophenol3,5-Dichloro-4-hydroxyanilinePhenol, 4-amino-2,6-dichloro-2,6-Dichloro-p-aminophenolI0L4CSX5N0DTXSID3040720NSC-156835DTXCID1020720RefChem:517554227-671-4

Show more names

4-AMino-2TIMTEC-BB SBB003766LABOTEST-BB LT01138431Lenvatinib Impurity 894-amino-2,6-dichloro-pheno2,6-dichloro-4-amine phenol2,6-dichloro-4-chloro phenol

MFCD000078754-Amino-2,6-dichloro-phenolUNII-I0L4CSX5N0EINECS 227-671-4Tox21_3016404-HYDROXY-3,5-DICHLOROANILINECS-W017353AS-10946

Database identifiers

CAS: 5930-28-9
PubChem CID: 80037
DTXSID: DTXSID3040720
ChEMBL: CHEMBL1454590
UNII: I0L4CSX5N0
EC Number: 227-671-4
Nikkaji: J60.894G

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 46.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 10
Formal charge: 0
Complexity: 110

Physicochemical properties

Melting point: 167 · 167-170 °C (lit.)
Boiling point: 303.6 · 303.6±42.0 °C(Predicted)
Density: 1.2549 · 1.2549 (rough estimate)
refractive index: 1.568 · 1.5680 (estimate)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: soluble in Methanol
pka: 7.29 · 7.29±0.23(Predicted)
form: Powder
color: Beige or slightly brown to pale reddish
BRN: 2361665 · 2361665
Stability: Stable. Incompatible with acids, acid chlorides, acid anhydrides, chloroformates, strong oxidizing agents.
InChI: InChI=1S/C6H5Cl2NO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H,9H2
InChIKey: KGEXISHTCZHGFT-UHFFFAOYSA-N
SMILES: C1(O)=C(Cl)C=C(N)C=C1Cl
CAS DataBase Reference: 5930 · 5930-28-9(CAS DataBase Reference)
FDA UNII: 0 L4CSX5N0 · I0L4CSX5N0
NIST Chemistry Reference: 4 · Phenol, 4-amino-2,6-dichloro-(5930-28-9)
EPA Substance Registry System: 4 · Phenol, 4-amino-2,6-dichloro- (5930-28-9)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319
Precautionary statements: 301 · P301+P312+P330-P302+P352-P305+P351+P338
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3
RTECS: 5774500 · SJ5774500
TSCA: TSCA listed
HS Code: 29222990 · 29222990
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 4 OralEye · Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
tsca: TSCA listed
rtecs: SJ5774500
hs_code: 29222990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-37/39
Storage Class: 11 - Combustible Solids
Hazard statements: H302-H315-H319
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2
Precautionary statements: P301+P312+P330-P302+P352-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPhenol, 4-amino-2,6-dichloro-: ACTIVE

Applications · 1 item

Uses4-Amino-2,6-dichlorophenol is used as an intermediate in pesticides, dyes, and pharmaceuticals. 2,6-Dichloro-4-aminophenol (also known as 3,5-dichloro-4-hydroxyaniline) is mainly used as an intermediate in the synthesis of the pesticide flufenoxuron, for the synthesis of 3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)aniline, or as an intermediate in the synthesis of flufenoxuron, 4-(3-chloro-5-trifluoromethylpyridin-2-oxy)-3,5-dichloroaniline.