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Ethanol, 2,2'-((4-(2-(2,6-dibromo-4-nitrophenyl)diazenyl)phenyl)imino)bis-, 1,1'-diacetate

HCID 108741
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
55619-18-6
Standard SMILES
CC(=O)OCCN(CCOC(C)=O)c1ccc(N=Nc2c(Br)cc([N+](=O)[O-])cc2Br)cc1
InChIKey
AKGBLCAZNYPAGT-UHFFFAOYSA-N
Molecular formula
C20H20Br2N4O6
Average molar mass
572.2 g/mol
Monoisotopic mass
569.97496

Names & identifiers

Preferred name
Ethanol, 2,2'-((4-(2-(2,6-dibromo-4-nitrophenyl)diazenyl)phenyl)imino)bis-, 1,1'-diacetate
IUPAC
2-[N-(2-acetyloxyethyl)-4-[(2,6-dibromo-4-nitrophenyl)diazenyl]anilino]ethyl acetate
English name
2,2'-[[4-[(2,6-dibromo-4-nitrophenyl)azo]phenyl]imino]bisethyl diacetate
Molecular formula
C20H20Br2N4O6
Molecular weight
572.2

Names & synonyms

55619-18-6EINECS 259-725-8Ethanol, 2,2'-((4-(2-(2,6-dibromo-4-nitrophenyl)diazenyl)phenyl)imino)bis-, 1,1'-diacetateEthanol, 2,2'-[[4-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]phenyl]imino]bis-, 1,1'-diacetateRefChem:138225Ethanol, 2,2'-[[4-[(2,6-dibromo-4-nitrophenyl)azo]phenyl]imino]bis-, diacetate (ester)Ethanol, 2,2'-((4-((2,6-dibromo-4-nitrophenyl)azo)phenyl)imino)bis-, diacetate (ester)DTXSID6069036AKGBLCAZNYPAGT-UHFFFAOYSA-N2,2'-((4-((2,6-Dibromo-4-nitrophenyl)azo)phenyl)imino)bisethyl diacetateNS00033357({4-[(2,6-Dibromo-4-nitrophenyl)diazenyl]phenyl}azanediyl)di(ethane-2,1-diyl) diacetate
Show more names
2,2'-[[4-[(2,6-dibromo-4-nitrophenyl)azo]phenyl]imino]bisethyl diacetate2,2'-[[4-[(2,6-Dibromo-4-nitrophenyl)azo]phenyl]imino]bisethanol diacetateEthanol, 2,2'-[[4-[(2,6-dibromo-4- nitrophenyl)azo]phenyl]imino]bis-, diacetate (ester)

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
126 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
11
Heavy atoms
32
Formal charge
0
Complexity
637

Physicochemical properties

Boiling point
640.2 · 640.2±55.0 °C(Predicted)
Density
1.61 · 1.61±0.1 g/cm3(Predicted)
pka
1.46 · 1.46±0.50(Predicted)
EPA Substance Registry System
2 · Ethanol, 2,2'-[[4-[(2,6-dibromo-4-nitrophenyl)azo]phenyl]imino]bis-, diacetate (ester) (55619-18-6)
TSCA
TSCA listed

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 · 3 items

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationHazard Traits - Bioaccumulation; Environmental Persistence
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationEthanol, 2,2'-[[4-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]phenyl]imino]bis-, 1,1'-diacetate: INACTIVE

Suppliers1 total

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
55619-18-6
PubChem CID
108741
DTXSID
DTXSID6069036
EC Number
259-725-8
Nikkaji
J267.035F