O-톨루이딘 수화염화물

O-톨루이딘수화염화물 · 2-메틸아닐린 염산염 · nci-c02335 · o-ToluidineHCL · 2-Toluidine HCl · o-Tolidine hydroch · ORTHO-TOLUIDINEHCL · rcrawastenumberu222

https://huagongshe.com/ko/chemical/12484

식별자 및 물리적 특성

CAS No.	636-21-5
분자식	C7H9N.ClH
평균 분자량	143.61 g/mol
단동위원소 질량	143.050177 g/mol
SMILES	Cc1ccccc1N.Cl
InChIKey	OGVXWEOZQMAAIM-UHFFFAOYSA-N
PubChem CID	12484
ChEMBL	CHEMBL1579403
EC No.	211-252-8
DTXSID	DTXSID7021364
현지명	O-톨루이딘 수화염화물

화학 및 물리적 성질

극성 표면적	26
수소 결합 공여자 수	2
수소 결합 수용자 수	1
회전 가능 결합 수	0
무거운 원자 수	9
형식 전하	0
복잡도	70.8
물질 분류	Nitrogen Compounds -> Amines, AromaticCarcinogens
Color/Form	MONOCLINIC PRISMS FROM COLD WATERRHOMBIC PYRAMIDS FROM HOT WATER
용해도	less than 1 mg/mL at 72 °F (NTP, 1992)VERY SOL IN WATERSOL IN ALCOHOLINSOL IN ETHER, INSOL IN BENZENEDMSO(약간 용해됨), 메탄올(약간 용해됨), 물(약간 용해됨)
끓는 점	468 °F at 760 mmHg (NTP, 1992)242.2 °C242 °C
Decomposition	When heated to decomp it emits very toxic fumes of /hydrogen chloride and nitrogen oxides/.
녹는점	419 °F (NTP, 1992)215 °C215-217 °C(lit.)
증기압	0.29 [mmHg]
Physical Description	O-toluidine hydrochloride appears as green crystals or white crystalline solid. Melting point 215-217 °F. Highly toxic.Green or white solid[CAMEO] Faintly grey powder[MSDSonline] Colorless to white solid[NTP]
밀도	1.0968 (rough estimate)
굴절률	1.5760 (estimate)
저장 조건	2-8°C
색상	흰색에서 회색으로
BRN	3558629
안정성	안정적인. 산화제, 알칼리와 호환되지 않습니다. 빛과 습기에 민감합니다.
주요 응용	의약품(소분자)
InChI	InChI=1S/C7H9N.ClH/c1-6-4-2-3-5-7(6)8/h2-5H,8H2,1H3
InChIKey	OGVXWEOZQMAAIM-UHFFFAOYSA-N
SMILES	C1(C)=CC=CC=C1N.Cl
EPA	o-Toluidine hydrochloride (636-21-5)

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류	DangerH302 (24.1%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, 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 58 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Hazard Traits - CarcinogenicityThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
운송 라벨(DOT)	Class 9
화재 위험	Flash point data for this chemical are not availablehowever, it is probably combustible. (NTP, 1992)
건강 유해성	SYMPTOMS: Symptoms of exposure to this compound include methemoglobinemia, cyanosis, central nervous system depression, vesiculation, anorexia, headache, weight loss, nausea, vomiting, diarrhea, dizziness, drowsiness, weakness, dyspnea, toxic psychosis, irritability, stupor, lethargy, unconsciousness, hemolytic anemia, kidney damage, anuria, liver damage, jaundice, bladder ulceration, hematuria and dermatitis. Symptoms of exposure to a related compound include anoxia. Eye burns may occur. Eye irritation may also occur. Other symptoms include skin irritation and coma. Inhalation may cause pallor, low-grade secondary anemia, fatigability and loss of appetite. Death may occur from severe exposure. Corneal damage has been reported.
유해성 요약	Known animal carcinogenEmergency treatment: Aniline[HSDB] An irritantMay cause cancerToxic by ingestion, inhalation, and skin absorption[Aldrich MSDS] See o-Toluidine.
반응성 그룹	Salts, Acidic
Special Reports	DHEW/NCIBioassay of o-Toluidine Hydrochloride for Possible Carcinogenicity (1979) Technical Rpt Series No. 153 DHEW Pub No. (NIH) 79-1709National Toxicology Program. Eleventh Report on Carcinogens (2005). The Report on Carcinogens is an informational scientific and public health document that identifies and discusses substances (including agents, mixtures, or exposure circumstances) that may pose a carcinogenic hazard to human health. o-Toluidine and o-Toluidine Hydrochloride (636-21-5) are listed as reasonably anticipated to be human carcinogens. /o-Toluidine and o-Toluidine Hydrochloride/[Available from, as of July 31, 2009: http://ntp.niehs.nih.gov/ntp/roc/eleventh/profiles/s178otol.pdf]

용도

o-Toluidine and o-toluidine hydrochloride are used primarily as intermediates in the manufacture of more than 90 dyes and pigments (NCI 1979, IARC 1982, 2000). They are used in acid-fast dyestuffs, azo pigments and dyes, triarylmethane dyes, sulfur dyes, and indigo compounds and as a photographic dye. o-Toluidine is also used as an intermediate for synthetic rubber and rubber vulcanizing chemicals, pharmaceuticals, and pesticides and as a curing agent in epoxy resin systems. Other minor uses of o-toluidine and its hydrochloride salt are as an intermediate in organic synthesis and as an ingredient in a clinical laboratory reagent for glucose and hemoglobin analyses.

일반 설명

Green crystals or white crystalline solid. Melting point 215-217°F. Highly toxic.