1-클로로-3,4-디니트로벤젠

4-Chloro-1,2-dinitrobenzene

HCID 33097CAS 610-40-2
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=[N+]([O-])c1ccc(Cl)cc1[N+](=O)[O-]
InChIKey
QVQSOXMXXFZAKU-UHFFFAOYSA-N
분자식
C6H3ClN2O4
평균 분자량
202.55 g/mol
단동위원소 질량
201.9781343

이름 및 식별자

우선 이름
4-Chloro-1,2-dinitrobenzene
IUPAC
4-chloro-1,2-dinitrobenzene
현지명
1-클로로-3,4-디니트로벤젠
영어명
3,4-Dinitrochlorobenzene
분자식
C6H3ClN2O4
분자량
202.55

이름 및 동의어

610-40-24-Chloro-1,2-dinitrobenzene1-Chloro-3,4-dinitrobenzeneBenzene, 4-chloro-1,2-dinitro-Z29B1F274E1,2-dinitro-4-chlorobenzeneEINECS 210-223-7NSC 119343NSC-119343DTXSID3060586RefChem:520704DTXCID7042932
이름 더 보기
1-클로로-3,4-디니트로벤젠1-클로로-3,4-다이나이트로벤젠Bendamustine Impurity 544-Chloro-1,2-dinitrobenzen3,4-Dinitrochlorobenzene>1-CHLORO-3,4-DINITROBENZENE1,2-Dinitro-5-chlorobenzene1-Chloro-3,4-dinitrobenzene, 92%+
210-223-73,4-DinitrochlorobenzeneMFCD000072124-chloro-1,2-dinitro-benzene1-Chloro-3.4-dinitrobenzeneSCHEMBL1524058AKOS015889665Q2651784

데이터베이스 식별자

CAS
610-40-2
PubChem CID
33097
DTXSID
DTXSID3060586
UNII
Z29B1F274E
EC Number
210-223-7
Nikkaji
J95.614G

물성

구조 계산 물성

XLogP
2.2
극성 표면적
91.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
0
무거운 원자 수
13

실험 및 물리화학적 성질

DensityRelative density (water = 1): 1.687
Flash Point>110 °C
Decomposition315 °C
Melting Point40-41 °C
Physical DescriptionYELLOW CRYSTALS.
Kovats Retention Index1546.8

물리화학적 성질

녹는점
40 · 40-41 °C
끓는 점
16 °C · 16 °C (4 mmHg)
밀도
1.687 g/mL · 1.687 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.587(lit.)
인화점
230 °F · >230 °F
저장 조건
0 · 0-10°C

화학적 성질

YELLOW-BROWN OILY LIQUID AFTER MELTING

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H311 (97.8%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H331 (91.1%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H373 (97.8%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]；H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (97.8%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P391, 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.；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.

유해성 정보

Regulatory InformationBenzene, 4-chloro-1,2-dinitro-: Does not have an individual approval but may be used under an appropriate group standard
Fire HazardsCombustible. Gives off irritating or toxic fumes (or gases) in a fire.
EC ClassificationSymbol: T, N; R: 23/24/25-33-50/53; S: (1/2)-28-36/37-45-60-61; Note: C
UN ClassificationUN Hazard Class: 6.1; UN Pack Group: II
Chemical DangersDecomposes on heating. This produces toxic and corrosive fumes. Reacts with strong oxidants and strong bases.
Packaging and LabellingDo not transport with food and feedstuffs. Marine pollutant.

안전 및 보호

Fire FightingUse water spray, powder, foam, carbon dioxide.
First Aid Measures · 4건

Fresh air, rest. Artificial respiration may be needed. Refer for medical attention.

First rinse with plenty of water for at least 15 minutes, then remove contaminated clothes and rinse again. Refer for medical attention .

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Rinse mouth. Induce vomiting (ONLY IN CONSCIOUS PERSONS!). Refer for medical attention .

Safe StorageSeparated from strong oxidants, strong bases and food and feedstuffs. Well closed. Keep in a well-ventilated room.
Spillage Disposal · 1건

Sweep spilled substance into covered containers. If appropriate, moisten first to prevent dusting. Carefully collect remainder. Then store and dispose of according to local regulations. Personal protection: chemical protection suit including self-contained breathing apparatus.

Eye PreventionWear face shield.
Fire PreventionNO open flames.

독성 정보

Exposure RoutesThe substance can be absorbed into the body by inhalation and through the skin.
Signs and Symptoms · 3건

Blue lips, fingernails and skin. Headache. Dizziness. Nausea. Confusion. Laboured breathing. Convulsions. Unconsciousness.

MAY BE ABSORBED! Further see Inhalation.

Further see Inhalation.

규제 정보

Regulatory InformationBenzene, 4-chloro-1,2-dinitro-: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN 3441 6.1/PG 2
HS 번호
2904990090
risk_code
23/24/25-33-50/53
hazard_code
T,N

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzene, 4-chloro-1,2-dinitro-: ACTIVE
응용 분야 · 3건

개요Securinine is derived from the leaf of Securinega suffruticosa Rehd., which was first separated by V.I.Murav’eva in 1956 . Securinega suffruticosa Rehd., a kind of subshrub plant, is widely distributed in temperate and subtropical regions . It has strong adaptability and can be planted in most parts of China. Moreover, it is rich in natural resources. Securinega suffruticosa Rehd. is a folk medicine whose root is the main component, with the effects of activating circulation, spleen, and stomach to treat rheumatism waist pain, limb numbness, infant malnutrition, and other diseases. The roots, stems, leaves, flowers, and skin of Securinega suffruticosa Rehd. contain alkaloids, in which securinine is the main ingredient.

역사Securinine was first isolated by a Soviet scholar from the Wusuli region, but its chemical structure was separated and finally determined by Chinese scholars from local sources . The main structural feature is a tetracyclic compound containing an indolizine, pyrrole elidine, or quinolizine ring and an α, β-unsaturated pentahydrin ring whose basic structural skeleton type is as shown in what follows .Owing to the complexity of the chemical reaction of securinine, reports on its chemical reactivity and structural modification have been relatively scarce since securinine was reported on in 1956. However, the research on chemical total synthesis and biological activities of securinine has made a certain amount of progress.Securinine has a rigid molecular structure containing four rings and three chiral centers, which makes synthesis difficult. From 1974 to 1978, three research groups from Japan, the USA, and Canada studied the biosynthesis of securinine by feeding animals with isotope-labeled S. suffruticosa.

용도3,4-Dinitrochlorobenzene is a useful reactant in organic synthesis.

상·하류 제품 정보

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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4-Chloro-1,2-dinitrobenzene (HCID 33097)｜Huagongshe