2-Methyl-6-nitroquinoline

SKL649 · AKOS 92899 · AKOS BBS-00003134 · 6-NITROQUINALDINE · 6-Nitro-2-methylquinoline · 2-methyl-6-nitro-quinolin · 2-METHYL-6-NITROQUINOLINE · 2-Methyl-6-nitroquinoxaline

https://huagongshe.com/ko/chemical/69172

식별자 및 물리적 특성

CAS No.	613-30-9
분자식	C10H8N2O2
평균 분자량	188.18 g/mol
단동위원소 질량	188.0585775 g/mol
SMILES	Cc1ccc2cc([N+](=O)[O-])ccc2n1
InChIKey	DXDPHHQJZWWAEH-UHFFFAOYSA-N
PubChem CID	69172
ChEMBL	CHEMBL1447249
EC No.	664-208-9
DTXSID	DTXSID3060619

화학 및 물리적 성질

XLogP	2.4
극성 표면적	58.7
수소 결합 공여자 수	0
수소 결합 수용자 수	3
회전 가능 결합 수	0
무거운 원자 수	14
형식 전하	0
복잡도	227
용해도	20.5 [ug/mL] (The mean of the results at pH 7.4)
녹는점	165 °C
끓는 점	334.7±22.0 °C(Predicted)
밀도	1.298±0.06 g/cm3(Predicted)
저장 조건	Sealed in dry,Room Temperature
물리적 상태	powder to crystal
pKa(산도 계수)	4.08±0.43(Predicted)
색상	White to Light yellow to Light orange
BRN	7915
EPA	Quinoline, 2-methyl-6-nitro- (613-30-9)

화학적 성질

2-Methyl-6-nitroquinoline is a solid, it reacts with oxidizing agents.

안전 및 규제

GHS 분류	DangerH302 (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 exposureRespiratory 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.
규제 정보	PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and Categories	Acute Tox. 4 (88.6%)Skin Irrit. 2 (100%)Eye Dam. 1 (86.4%)Eye Irrit. 2A (13.6%)STOT SE 3 (97.7%)
TSCA 등재 상태	TSCA listed
관세 코드	2933499090
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36/37/39
위험 참고 사항	Irritant

용도

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