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1-(4-Methylphenyl)-3-(phenylmethyl)-1-triazene

HCID 87234
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Basic information

CAS
17683-09-9
Standard SMILES
Cc1ccc(NN=NCc2ccccc2)cc1
InChIKey
IWCGEJKKDAJKJE-UHFFFAOYSA-N
Molecular formula
C14H15N3
Average molar mass
225.29 g/mol
Monoisotopic mass
225.12659749

Names & identifiers

Preferred name
1-(4-Methylphenyl)-3-(phenylmethyl)-1-triazene
IUPAC
N-(benzyldiazenyl)-4-methylaniline
English name
1-Benzyl-3-p-tolyltriazene
Molecular formula
C14H15N3
Molecular weight
225.29

Names & synonyms

17683-09-91-Triazene, 1-(4-methylphenyl)-3-(phenylmethyl)-1-(4-Nitrobenzyl)-3-(4-tolyl)triazeneDTXSID0066244RefChem:425960DTXCID90356281-(4-Methylphenyl)-3-(phenylmethyl)-1-triazene241-665-91-Benzyl-3-p-tolyltriazeneN-(benzyldiazenyl)-4-methylaniline3-Benzyl-1-p-tolyltriazene1-Benzyl-3-(p-tolyl)-1-triazine
Show more names
3-P-TOLYL-1-BENZYLTRIAZENEesterificatingagentforGCandHPLC1-Benzyl-3-p-tolyltriazene 1-Benzyl-3-(p-tolyl)triaz-1-ene
1-BENZYL-3-(4-METHYLPHENYL)TRIAZ-1-ENE1-Benzyl-3-(p-tolyl)triaz-1-eneMFCD000382263-benzyl-1-(4-methylphenyl)triaz-1-eneCCRIS 7989EINECS 241-665-91-Benzyl-3-p-tolytriazeneN-benzylazo-4-methyl-aniline

Database identifiers

CAS
17683-09-9
PubChem CID
87234
DTXSID
DTXSID0066244
EC Number
241-665-9
Nikkaji
J208.073G

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
36.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
226

Physicochemical properties

Melting point
77 °C · 77 °C
Boiling point
359.3 · 359.3±45.0 °C(Predicted)
Density
1.05 · 1.05±0.1 g/cm3(Predicted)
storage temp.
Refrigerator
solubility
soluble in Ether
form
powder to crystal
pka
2.83 · 2.83±0.70(Predicted)
color
White to Yellow to Orange
CAS DataBase Reference
17683 · 17683-09-9
EPA Substance Registry System
1 · 1-Triazene, 1-(4-methylphenyl)-3-(phenylmethyl)- (17683-09-9)
Symbol(GHS)
2 · GHS02,GHS07
Signal word
Danger
Hazard statements
228 · H228-H302+H312+H332
Precautionary statements
210 · P210-P240-P241-P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501
RIDADR

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

Danger

H228 (100%): Flammable solid [Danger Flammable solids]

P210, P240, P241, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P370+P378, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Sol. 1 (100%)

Safety data

tsca
TSCA listed
ridadr
1325
hs_code
2927.00.5000
Signal word
Danger
Symbol(GHS)
GHS02,GHS07
hazard_class
4.1
packing_group
II
Hazard statements
H228-H302+H312+H332
Precautionary statements
P210-P240-P241-P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Triazene, 1-(4-methylphenyl)-3-(phenylmethyl)-: INACTIVE

Related reactions

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Compound notes

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1325 · 1325
TSCA
TSCA listed
HS Code
2927 · 2927.00.5000
HazardClass
4.1 · 4.1
PackingGroup
II