2-(3-Chlorophenoxy)ethylamine

HCID 14245331

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Basic information

CAS: 6488-00-2
Standard SMILES: NCCOc1cccc(Cl)c1
InChIKey: SKLZUIZCCAYHOB-UHFFFAOYSA-N
Molecular formula: C8H10ClNO
Average molar mass: 171.62 g/mol
Monoisotopic mass: 171.04509162

Names & identifiers

Preferred name: 2-(3-Chlorophenoxy)ethylamine
IUPAC: 2-(3-chlorophenoxy)ethanamine
English name: [2-(3-Chlorophenoxy)ethyl]amine
Molecular formula: C8H10ClNO
Molecular weight: 171.62

Names & synonyms

2-(3-Chlorophenoxy)ethylamine2-[3-Chlorophenoxy]ethylamineRefChem:455376813-885-06488-00-22-(3-chlorophenoxy)ethanamine[2-(3-Chlorophenoxy)ethyl]amine2-(3-Chlorophenoxy)ethan-1-amineMFCD00052976Ethanamine, 2-(3-chlorophenoxy)-1-(2-aminoethoxy)-3-chlorobenzene2-(3-Chlorophenoxy)

Show more names

MFCD117323322-(3-cholorophenoxy)ethylamine2-(3-chlorophenoxy)ethanamine hydrochloride[2-(3-chlorophenoxy)ethyl]amine hydrochloride

SCHEMBL3167075RARECHEM AL BW 0342DTXSID10557914SKLZUIZCCAYHOB-UHFFFAOYSA-NALBB-010364BBL008277SBB050335STK664136

Database identifiers

CAS: 6488-00-2
PubChem CID: 14245331
DTXSID: DTXSID10557914
EC Number: 813-885-0

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 35.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 110

Physicochemical properties

Boiling point: 148 · 148-150 °C(Press: 16 Torr)
Density: 1.178 · 1.178±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 8.35 · 8.35±0.10(Predicted)
form: liquid
color: Yellow
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280
Hazard Codes: Xi
RIDADR: 2735 · UN2735
HazardClass: IRRITANT
HS Code: 2922290090 · 2922290090
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, 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 CategoriesSkin Corr. 1B (100%)

Safety data

ridadr: UN2735
hs_code: 2922290090
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: Xi
hazard_class: IRRITANT
Hazard statements: H314
Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements: P280