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2-(2,4-Dinitrophenoxy)ethanol

HCID 76070
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2831-60-9
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 propertiesFilling in

XLogP
1.3
Topological polar surface area
121 Ų
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

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

tsca
TSCA listed
ridadr
1325
hs_code
2904200090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
hazard_class
4.1
packing_group
III
Hazard statements
H319-H335-H302+H312+H332-H315
REACH Registrations
Active
Precautionary statements
P280-P301+P312-P304+P340

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationEthanol, 2-(2,4-dinitrophenoxy)-: INACTIVE

Upstream & downstream products

Upstream raw materials

Potassium hydroxideEthylene glycol2,4-Dinitrochlorobenzene

Related reactions

7 records
New reaction record
HRID 107612 reaction equation
HRID 107612As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 380718 reaction equation
HRID 380718As productuspto-grants-2001_10
HRID 1531475 reaction equation
HRID 1531475As productuspto-grants-2001_03
HRID 1531476 reaction equation
HRID 1531476As productuspto-grants-2001_03
HRID 1531477 reaction equation
HRID 1531477As productuspto-grants-2001_03
HRID 1532795 reaction equation
HRID 1532795As reactantuspto-grants-2001_03
HRID 2120314 reaction equation
HRID 2120314As productuspto-grants-2004_02

Compound notes

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