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N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]acetamide

HCID 104232
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
52549-57-2
Standard SMILES
COCCN(CCOC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2C#N)c(NC(C)=O)c1
InChIKey
DMMDCPMHDXAIRV-UHFFFAOYSA-N
Molecular formula
C21H24N6O5
Average molar mass
440.5 g/mol
Monoisotopic mass
440.18081789

Names & identifiers

Preferred name
N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]acetamide
IUPAC
N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)diazenyl]phenyl]acetamide
English name
N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]acetamide
Molecular formula
C21H24N6O5
Molecular weight
440.45

Names & synonyms

N-[5-[BIS(2-METHOXYETHYL)AMINO]-2-[(2-CYANO-4-NITROPHENYL)AZO]PHENYL]ACETAMIDEEINECS 257-999-3Acetamide, N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]-DTXSID7068764N-(5-(Bis(2-methoxyethyl)amino)-2-((2-cyano-4-nitrophenyl)azo)phenyl)acetamideAcetamide, N-(5-(bis(2-methoxyethyl)amino)-2-((2-cyano-4-nitrophenyl)azo)phenyl)-Acetamide, N-(5-(bis(2-methoxyethyl)amino)-2-(2-(2-cyano-4-nitrophenyl)diazenyl)phenyl)-Acetamide, N-[5-[bis(2-methoxyethyl)amino]-2-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-RefChem:828009DTXCID2041208257-999-352549-57-2
Show more names
Disperse Violet 77C.I.Disperse Violet 77:C.I.113382C.I. Disperse Violet 77 press cake
N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)diazenyl]phenyl]acetamideN-{5-[Bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)diazenyl]phenyl}acetamideSCHEMBL9589087SCHEMBL9589094DMMDCPMHDXAIRV-UHFFFAOYSA-NDB-298680NS00032526N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl ]acetamide

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
145 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
10
Heavy atoms
32
Formal charge
0
Complexity
682

Physicochemical properties

EPA Substance Registry System
5 · Acetamide, N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]- (52549-57-2)
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% (10 of 10) of all reports.

Not Classified

Aggregated GHS information provided per 10 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationChemical: Acetamide, N-[5-[bis(2-methoxyethyl)amino]-2-[(2-cyano-4-nitrophenyl)azo]phenyl]-
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetamide, N-[5-[bis(2-methoxyethyl)amino]-2-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-: ACTIVE

Suppliers2 total

重庆卡兰医药有限公司[email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]

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Compound notes

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

Database identifiers

CAS
52549-57-2
PubChem CID
104232
DTXSID
DTXSID7068764
EC Number
257-999-3
Nikkaji
J295.692F