Quinoline, 2-hydrazinyl-

HCID 85111

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Basic information

CAS: 15793-77-8
Standard SMILES: NNc1ccc2ccccc2n1
InChIKey: QMVCLSHKMIGEFN-UHFFFAOYSA-N
Molecular formula: C9H9N3
Average molar mass: 159.19 g/mol
Monoisotopic mass: 159.07964729

Names & identifiers

Preferred name: Quinoline, 2-hydrazinyl-
IUPAC: quinolin-2-ylhydrazine
English name: 2-Hydrazinoquinoline
Molecular formula: C9H9N3
Molecular weight: 159.19

Names & synonyms

2-Hydrazinoquinoline15793-77-82-QuinolylhydrazineQuinoline, 2-hydrazino-Quinoline, 2-hydrazinyl-alpha-QuinolylhydrazineEINECS 239-899-1NSC 525792RefChem:871992239-899-12-Hydrazinylquinoline2(1H)-Quinolinone, hydrazone

Show more names

AKOS AUF020552-HYDRAZINEQUINOLINEOTAVA-BB BB01382100672-hydrazineylquinoline

quinolin-2-ylhydrazineMFCD00041860quinolin-2-yl-hydrazine.alpha.-QuinolylhydrazineNSC-525792hydrazinoquinolinequinolone hydrazoneNSC525792

Database identifiers

CAS: 15793-77-8
PubChem CID: 85111
DTXSID: DTXSID4065945
UNII: 3MG52EZF59
EC Number: 239-899-1
Nikkaji: J208.561E

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 50.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 149

Physicochemical properties

Melting point: 142 °C · 142°C
Boiling point: 303.1 · 303.1±45.0 °C(Predicted)
Density: 1.25 · 1.25±0.1 g/cm3(Predicted)
storage temp.: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
solubility: Soluble in methanol.
pka: 5.41 · 5.41±0.20(Predicted)
form: powder to crystal
color: Light yellow to Brown
CAS DataBase Reference: 15793 · 15793-77-8(CAS DataBase Reference)
FDA UNII: 3 MG52EZF59 · 3MG52EZF59
EPA Substance Registry System: 2 · 2(1H)-Quinolinone, hydrazone (15793-77-8)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes: Xn
Risk Statements: 20 · 20/21/22-36/37/38-41-22
Safety Statements: 26 · 26-36/37/39-39
TSCA: TSCA listed
HS Code: 2933491090 · 2933491090

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (91.1%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (91.1%)

Safety data

tsca: TSCA listed
hs_code: 2933491090
risk_code: 20/21/22-36/37/38-41-22
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xn
safety_code: 26-36/37/39-39
Hazard statements: H302+H312+H332-H315-H319-H335
Precautionary statements: P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationQuinoline, 2-hydrazinyl-: INACTIVE

Applications

Uses2-Hydrazinoquinoline acts as as a derivatization agent for LC-MS-based metabolomic investigation of diabetic ketoacidosis. It is used in agrochemical, pharmaceutical and dyestuff field.