Benzoyl chloride, 3-nitro-

3-NITROBENZOYL CHLORIDE · m-Nitrobenzoyl chlor · LABOTEST-BB LTBB000612 · m-Nitrobenzoylchroride · 3-nitro-benzoylchlorid · m-nitro-benzoylchlorid · M-NITROBENZOYL CHLORIDE · 1 m-Nitrobenzoyl Chloro

https://huagongshe.com/ko/chemical/8495

식별자 및 물리적 특성

CAS No.	121-90-4
분자식	C7H4ClNO3
평균 분자량	185.56 g/mol
단동위원소 질량	184.98797067 g/mol
SMILES	O=C(Cl)c1cccc([N+](=O)[O-])c1
InChIKey	NXTNASSYJUXJDV-UHFFFAOYSA-N
PubChem CID	8495
ChEMBL	CHEMBL1517721
EC No.	204-505-9
DTXSID	DTXSID9025740

화학 및 물리적 성질

XLogP	2.8
극성 표면적	62.9
수소 결합 공여자 수	0
수소 결합 수용자 수	3
회전 가능 결합 수	1
무거운 원자 수	12
형식 전하	0
복잡도	201
SpringerMaterials Properties	Boiling point
용해도	Decomposes (NTP, 1992)soluble in Ether,Benzene,Toluene
인화점	greater than 233.6 °F (NTP, 1992)>230 °F
끓는 점	527 to 532 °F at 760 mmHg (NTP, 1992)275-278 °C(lit.)
녹는점	95 °F (NTP, 1992)31-34 °C(lit.)
증기 밀도	6.43 (NTP, 1992) - Heavier than airwill sink (Relative to Air)
Physical Description	M-nitrobenzoyl chloride is a yellow to brown liquid. Unstable at room temperaturesrequires refrigeration when not in use.
밀도	1.42
굴절률	1.5810 (estimate)
물리적 상태	저융점 고체
색상	갈색
비중	1.59
용해도	물에서 분해되다
BRN	777186
InChI	1S/C7H4ClNO3/c8-7(10)5-2-1-3-6(4-5)9(11)12/h1-4H
InChIKey	NXTNASSYJUXJDV-UHFFFAOYSA-N
SMILES	[O-][N+](=O)c1cccc(c1)C(Cl)=O
NIST	Benzoyl chloride, 3-nitro-(121-90-4)
EPA	m-Nitrobenzoyl chloride (121-90-4)

화학적 성질

BROWN LOW MELTING SOLID

안전 및 규제

GHS 분류	DangerH311 (89.1%): Toxic in contact with skin [Danger Acute toxicity, dermal]P260, P262, P264, P264+P265, P270, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P361+P364, P362+P364, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
운송 라벨(DOT)	Corrosive
화재 위험	This chemical is combustible. (NTP, 1992)
건강 유해성	ACUTE/CHRONIC HAZARDS: This chemical is unstable at room temperature or when exposed to sources of ignition. When heated to decomposition it emits highly toxic fumes. It will react with water or steam to produce toxic and corrosive fumes. (NTP, 1992)
반응성 그룹	Nitro, Nitroso, Nitrate, and Nitrite Compounds, Organic
Reactivity Alerts	Water-Reactive
Reactivity Profile	M-NITROBENZOYL CHLORIDE is incompatible with bases (including amines), with strong oxidizing agents, and with alcohols. May react with reducing agents. May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].
Air and Water Reactions	May be unstable to prolonged exposure to air. Decomposes in water and alcohol. (NTP, 1992).
Hazard Classes and Categories	Acute Tox. 3 (89.1%)
소화	Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
응급 처치	EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

용도

Manufacture of dyes for fabrics and color photography, intermediate in preparation of pharmaceuticals.

일반 설명

Yellow to brown liquid. Unstable at room temperatures; requires refrigeration when not in use.