CAS 613-30-9 2-Methyl-6-nitroquinoline (HCID 69172)

Names & identifiers

Preferred name: 2-Methyl-6-nitroquinoline
IUPAC: 2-methyl-6-nitroquinoline
English name: 2-METHYL-6-NITROQUINOLINE
Molecular formula: C10H8N2O2
Molecular weight: 188.18

Names & synonyms

2-Methyl-6-nitroquinolineQuinoline, 2-methyl-6-nitro-DTXSID3060619RefChem:88210DTXCID1042998664-208-9DXDPHHQJZWWAEH-UHFFFAOYSA-N613-30-96-NitroquinaldineMFCD00051736HMS2802G10CCG-40762

Show more names

SKL649AKOS 92899AKOS BBS-000031346-Nitro-2-methylquinoline2-methyl-6-nitro-quinolin2-Methyl-6-nitroquinoxaline2-Methyl-6-nitroquinoline>

SY020324EN300-129756F2100-0099Quinoline,2-methyl-6-nitro-Maybridge1_001441A833167Oprea1_276369MLS000833689

Database identifiers

CAS: 613-30-9
PubChem CID: 69172
DTXSID: DTXSID3060619
ChEMBL: CHEMBL1447249
EC Number: 664-208-9
Nikkaji: J95.081E

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 58.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 14
Formal charge: 0
Complexity: 227

Experimental & physicochemical properties

Solubility20.5 [ug/mL] (The mean of the results at pH 7.4)

Physicochemical properties

Melting point: 165 °C · 165 °C
Boiling point: 334.7 · 334.7±22.0 °C(Predicted)
Density: 1.298 · 1.298±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
form: powder to crystal
pka: 4.08 · 4.08±0.43(Predicted)
color: White to Light yellow to Light orange
BRN: 7915 · 7915
CAS DataBase Reference: 613 · 613-30-9(CAS DataBase Reference)
EPA Substance Registry System: 2 · Quinoline, 2-methyl-6-nitro- (613-30-9)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36/37/39
Hazard Note: Irritant
TSCA: TSCA listed
HS Code: 2933499090 · 2933499090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (86.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (13.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesAcute Tox. 4 (88.6%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (86.4%)；Eye Irrit. 2A (13.6%)；STOT SE 3 (97.7%)

Regulatory information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Safety data

tsca: TSCA listed
hs_code: 2933499090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-36/37/39
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationQuinoline, 2-methyl-6-nitro-: ACTIVE

Applications

Uses2-Methyl-6-nitroquinoline is a reagent that is used as a potent, selective, and orally efficacious antagonists of melanin-concentrating hormone receptor 1.