2-(2,4-Dinitrophenoxy)ethanol

HCID 76070CAS 2831-60-9

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Basic information

Standard SMILES: O=[N+]([O-])c1ccc(OCCO)c([N+](=O)[O-])c1
InChIKey: YYTMNJWMYPSLOD-UHFFFAOYSA-N
Molecular formula: C8H8N2O6
Average molar mass: 228.16 g/mol
Monoisotopic mass: 228.03823598

Names & identifiers

Preferred name: 2-(2,4-Dinitrophenoxy)ethanol
IUPAC: 2-(2,4-dinitrophenoxy)ethanol
English name: 2-(2,4-Dinitrophenoxy)ethanol
Molecular formula: C8H8N2O6
Molecular weight: 228.16

Names & synonyms

2-(2,4-Dinitrophenoxy)ethanolEthanol, 2-(2,4-dinitrophenoxy)-2,4-Dinitrophenoxyethanol1-(2-Hydroxyethoxy)-2,4-dinitrobenzenebeta-Hydroxyethyl 2,4-dinitrophenyl etherEINECS 220-597-3NSC 28669DTXSID8062656RefChem:83935DTXCID4037798220-597-32831-60-9

Show more names

dinitrophenoxyethanol2,4-DINITROPHENOXY-2-ETHANOL2-(2,4-Dinitrophenoxy)ethanol ,98%

2-(2,4-dinitrophenoxy)ethan-1-olMFCD00052808NSC-286692-(24-DINITROPHENOXY)ETHANOL.beta.-Hydroxyethyl 2,4-dinitrophenyl etherMaybridge1_002900QWS7ZCG55MEthanol,4-dinitrophenoxy)-

Database identifiers

CAS: 2831-60-9
PubChem CID: 76070
DTXSID: DTXSID8062656
UNII: QWS7ZCG55M
EC Number: 220-597-3
Nikkaji: J306.764E

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 121 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 260

Physicochemical properties

EPA Substance Registry System: 2 · Ethanol, 2-(2,4-dinitrophenoxy)- (2831-60-9)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H302+H312+H332-H315
Precautionary statements: 280 · P280-P301+P312-P304+P340
Hazard Codes: Xi
RIDADR: 1325 · 1325
Hazard Note: Irritant
TSCA: TSCA listed
HazardClass: 4.1 · 4.1
PackingGroup: III
HS Code: 2904200090 · 2904200090
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P270, P272, P273, P280, P301+P316, P302+P352, P321, P330, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.