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2-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol

HCID 339622
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Basic information

CAS
14337-53-2
Standard SMILES
CCN(CC)c1ccc(N=Nc2ccc(Br)cn2)c(O)c1
InChIKey
HNVCXDAVEHOIBP-UHFFFAOYSA-N
Molecular formula
C15H17BrN4O
Average molar mass
349.23 g/mol
Monoisotopic mass
348.05857

Overview

See also: 2-(5-Bromo-2-pyridylazo)-5-diethylaminophenol (annotation moved to) ... View More ...

Names & identifiers

Preferred name
2-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol
IUPAC
2-[(5-bromo-2-pyridinyl)diazenyl]-5-(diethylamino)phenol
English name
2-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol
Molecular formula
C15H17BrN4O
Molecular weight
349.23

Names & synonyms

14337-53-22-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol2-((5-Bromopyridin-2-yl)diazenyl)-5-(diethylamino)phenolBromo-PADAP5-Br-PADAPMFCD000062552-(5-Bromo-2-pyridinylazo)-5-(diethylamino)phenol2-(4-Diethylamino-2-hydroxyphenylazo)-5-bromopyridineC15H17BrN4OCyto5G2Phenol, 2-[(5-bromo-2-pyridinyl)azo]-5-(diethylamino)-2-(5-Bromo-2-pyridylazo)-5-diethylaminophenol
Show more names
5-Br-DEPAPNSC 36708115N-Labeled Boc-L-ArginineSilver reagent coloring solution2-(5-BROMO-2-PYRIDYLAZO)-5-(DIETHYLAMIN&5-diethylamino-2-(5-bromo-2-pyridylazo)phenol
2-[(1E)-2-(5-bromopyridin-2-yl)diazen-1-yl]-5-(diethylamino)phenolNSC-3670812-[(5-bromopyridin-2-yl)diazenyl]-5-(diethylamino)phenol2-[2-(5-Bromo-2-pyridinyl)diazenyl]-5-(diethylamino)phenolBromo PADAPNSC3670815-Bromo-DEPAP5-Bromo-PADAP

Database identifiers

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
61.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
338

Experimental & physicochemical properties

LogP4.23

Physicochemical properties

Melting point
155 · 155-160 °C
Boiling point
511.1 · 511.1±50.0 °C(Predicted)
Density
1.39 · 1.39±0.1 g/cm3(Predicted)
storage temp.
2 · Sealed in dry,2-8°C
pka
8.56 · 8.56±0.40(Predicted)
form
Crystalline Powder
color
Red
λmax
443 nm · 443 nm
BRN
430511 · 430511
Major Application
diagnostic assay manufacturinghematologyhistology
InChI
InChI=1S/C15H17BrN4O/c1-3-20(4-2)12-6-7-13(14(21)9-12)18-19-15-8-5-11(16)10-17-15/h5-10,21H,3-4H2,1-2H3
InChIKey
HNVCXDAVEHOIBP-VHEBQXMUSA-N
SMILES
C1(O)=CC(N(CC)CC)=CC=C1N=NC1=NC=C(Br)C=C1

Safety & regulation

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

Hazard information

Regulatory Information2-(5-Bromo-2-pyridylazo)-5-(diethylamino) phenol: Does not have an individual approval but may be used under an appropriate group standard

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
hs_code
29333990
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
24/25-22
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313

Chemistry & industry

Applications · 1 item

Uses2-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol is used in the spectrophotometric flow injection assay for the determination of trace amount of thiocyanate level in saliva from smokers and non-smokers, also in the spectrophotometric investigation of sensitive complexing agents for the determination of zinc in serum. Dyes and metabolites.

Upstream & downstream products

Upstream raw materials

2-ButanolAcetoneSodium sulfateHydrazine hydrateDiethylaminePolyethylene Glycol2,5-DibromopyridineCatecholSilver(II) oxideAcetic acid2-Aminopyridine

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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CAS
14337-53-2
PubChem CID
339622
DTXSID
DTXSID70871961
UNII
ZTC96V5DTP
Nikkaji
J1.856.563C、J208.086I
CAS DataBase Reference
14337 · 14337-53-2(CAS DataBase Reference)
FDA UNII
96 V5DTP · ZTC96V5DTP
UNSPSC Code
12171500 · 12171500
NACRES
47 · NA.47
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
PPE
95 · Eyeshields, Gloves, type N95 (US)
Safety Statements
24 · 24/25-22
WGK Germany
3 · 3
HS Code
29333990 · 29333990
Storage Class
11 · 11 - Combustible Solids