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Acetamide, N-[2-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-

HCID 112676
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Basic information

CAS
63467-23-2
Standard SMILES
CCN(CC(O)CO)c1ccc(N=Nc2c(Br)cc([N+](=O)[O-])cc2Br)c(NC(C)=O)c1
InChIKey
ITTWJNZGMUYBLD-UHFFFAOYSA-N
Molecular formula
C19H21Br2N5O5
Average molar mass
559.2 g/mol
Monoisotopic mass
556.99094

Names & identifiers

Preferred name
Acetamide, N-[2-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-
IUPAC
N-[2-[(2,6-dibromo-4-nitrophenyl)diazenyl]-5-[2,3-dihydroxypropyl(ethyl)amino]phenyl]acetamide
English name
N-[2-[(2,6-Dibromo-4-nitrophenyl)azo]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]acetamide
Molecular formula
C19H21Br2N5O5
Molecular weight
559.21

Names & synonyms

Acetamide, N-(2-((2,6-dibromo-4-nitrophenyl)azo)-5-((2,3-dihydroxypropyl)ethylamino)phenyl)-DTXSID20886606Acetamide, N-(2-(2-(2,6-dibromo-4-nitrophenyl)diazenyl)-5-((2,3-dihydroxypropyl)ethylamino)phenyl)-Acetamide, N-[2-[(2,6-dibromo-4-nitrophenyl)azo]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-Acetamide, N-[2-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-RefChem:551818DTXCID00102593063467-23-2ITTWJNZGMUYBLD-UHFFFAOYSA-NN-{2-[(2,6-Dibromo-4-nitrophenyl)diazenyl]-5-[(2,3-dihydroxypropyl)(ethyl)amino]phenyl}acetamideN-[2-[(2,6-Dibromo-4-nitrophenyl)azo]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]acetamideAcetamide,N-[2-[(2,6-dibromo-4-nitrophenyl)azo]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-

Database identifiers

CAS
63467-23-2
PubChem CID
112676
DTXSID
DTXSID20886606
Nikkaji
J429.578A

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
143 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
31
Formal charge
0
Complexity
625

Physicochemical properties

Boiling point
768.3 · 768.3±60.0 °C(Predicted)
Density
1.71 · 1.71±0.1 g/cm3(Predicted)
pka
13.85 · 13.85±0.20(Predicted)
EPA Substance Registry System
2 · Acetamide, N-[2-[(2,6-dibromo-4-nitrophenyl)azo]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]- (63467-23-2)
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.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationAcetamide, N-[2-[2-(2,6-dibromo-4-nitrophenyl)diazenyl]-5-[(2,3-dihydroxypropyl)ethylamino]phenyl]-: INACTIVE

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