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Nsc5063

HCID 221124
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Basic information

CAS
10329-15-4
Standard SMILES
O=C(N=Nc1ccccc1)NNc1ccccc1.O=C(NNc1ccccc1)NNc1ccccc1
InChIKey
WDJPBIRJSVMEKJ-UHFFFAOYSA-N
Molecular formula
C26H26N8O2
Average molar mass
482.5 g/mol
Monoisotopic mass
482.2178721

Names & identifiers

Preferred name
Nsc5063
IUPAC
1-anilino-3-phenyliminourea;1,3-dianilinourea
English name
S-Diphenylcarbazone
Molecular formula
C13H14N4O.C13H12N4O
Molecular weight
482.54

Names & synonyms

10329-15-4NSC5063NSC 5063N',2-Diphenyldiazenecarbohydrazide compound with N'',N'''-diphenylcarbonohydrazide (1:1)RefChem:8549171-anilino-3-phenyliminourea;1,3-dianilinoureaNSC-5063MFCD00013218Carbohydrazide, 1,5-diphenyl-, compd. with (phenylazo)formic acid 2-phenylhydrazide (1:1)Diphenylcarbazone compound with 1,5-diphenylcarbohydrazide(3E)-1-anilino-3-phenylimino-urea; 1,3-dianilinourea1,5-Diphenylcarbazone Compound With 1,5-Diphenylcarbazide
Show more names
DIPHENYLCARBAZONES-DiphenylcarbazoneDIPHENYLCARBAZONE REAGENTs-DiphenylcarbazoneCompoundDiphenyl azo carbonyl hydrazides-Diphenylcarbazone, ACS reagent, 98%DIPHENYLCARBAZONE COMPOUND WITH S-DIPHEN YLCARBAZIDDIPHENYLCARBAZONE COMPOUND WITH S-DIPHENYLCARBAZIDEDiphenylcarbazone,compoundwith1,5-diphenylcarbazideS-DIPHENYLCARBAZONE COMPOUND WITH S-DIPHENYLCARBAZIDE
Phenylazoformic acid 2-phenylhydrazide compound with 1,5-Diphenylcarbohydrazide9C989Y6W8JAKOS015913529DB-040437E85377DIPHENYLCARBAZONE COMPOUND with S-DIPHENYL CARBAZIDE, ACSFormic acid, (phenylazo)-, 2-phenylhydrazide, compd. with 1,5-diphenylcarbohydrazideFormic acid, (phenylazo)-, 2-phenylhydrazide, compd. with 1,5-diphenylcarbohydrazide (1:1)

Database identifiers

CAS
10329-15-4
PubChem CID
221124
UNII
9C989Y6W8J
EC Number
623-741-7

Properties

Computed structural properties

Topological polar surface area
131 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
36
Formal charge
0
Complexity
504

Physicochemical properties

Melting point
159 · 159-161°C
storage temp.
Store at RT.
form
Powder
color
Orange
Water Solubility
Solubility in water, acetone.
Merck
14 · 14,3322
BRN
6110063 · 6110063
CAS DataBase Reference
10329 · 10329-15-4(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36

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

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 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 CategoriesSkin Irrit. 2 (100%)

Safety data

risk_code
36/37/38
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Applications · 1 item

UsesPhenylazoformic acid 2-phenylhydrazide compound with 1,5-Diphenylcarbohydrazide is used as an indicator in titrating iron and for the colorimetric determination of chromium and the detection of cadmium, mercury, magnesium, aldehydes, and emetine, a color developing agent.

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