Leucocrystal Violet (HCID 69048)

이름 및 식별자

우선 이름: Leucocrystal Violet
IUPAC: 4-[bis[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline
영어명: Leucocrystal Violet
분자식: C25H31N3
분자량: 373.53

이름 및 동의어

Leucocrystal Violet603-48-5Leucogentian violetLeucomethyl green4,4',4''-Methylidynetris(N,N-dimethylaniline)C.I. Basic Violet 3, leuco3LBR3LR8FSTris(4-(dimethylamino)phenyl)methane4,4',4''-(Hexamethyltriamino)triphenylmethane4,4',4''-Tris(N,N-dimethylaminophenyl)methaneDTXSID3060530Benzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-

이름 더 보기

LCVLEUCO CRYSTAL VIOLETLeuco4,4',4''-Methanetriyltris(N,N-dimethylaniline)PI-LCVLeucocrystalLeuco VioletGrystal Violet

NSC-7338LEUCO BASIC VIOLET 3Benzenamine, 4,4',4''-methylidynetris(N,N-dimethyl-Aniline, 4,4',4''-methylidynetris(N,N-dimethyl-Aniline, 4,4',4''-methylidynetris[N,N-dimethyl-Tris[4-(dimethylamino)phenyl]methaneRefChem:798978DTXCID1042788

데이터베이스 식별자

CAS: 603-48-5
PubChem CID: 69048
DTXSID: DTXSID3060530
ChEMBL: CHEMBL81595
ChEBI: CHEBI:182175
UNII: 3LBR3LR8FS
EC Number: 210-043-9
Nikkaji: J43.062E

물성

구조 계산 물성

XLogP: 5.7
극성 표면적: 9.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 6
무거운 원자 수: 28
형식 전하: 0
복잡도: 370

실험 및 물리화학적 성질

Physical DescriptionWhite to very pale lavender powder; [IARC]

Collision Cross Section216.47 Å² [M+H]+

물리화학적 성질

녹는점: 175 · 175-177 °C(lit.)
끓는 점: 492.75 °C · 492.75°C (rough estimate)
밀도: 1.1857 · 1.1857 (rough estimate)
증기압: 0 · 0-0Pa at 10-30℃
굴절률: 1.627 · 1.6270 (estimate)
저장 조건: Amber Vial, Refrigerator
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 5.93 · 5.93±0.24(Predicted)
물리적 상태: 가루
색상: 흰색에서 밝은 회색, 약간 라벤더색까지
Henry's Law Constant: 6.4 · 6.4×104 mol/(m3Pa) at 25℃, Zhang et al. (2010)
안정성: 안정적이지만 가볍고 공기에 민감합니다. 강한 산화제와 호환되지 않습니다.
주요 응용: 진단 검사 제조혈액학조직학
InChI: 1S/C25H31N3/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6/h7-18,25H,1-6H3
InChIKey: OAZWDJGLIYNYMU-UHFFFAOYSA-N
SMILES: CN(C)c1ccc(cc1)C(c2ccc(cc2)N(C)C)c3ccc(cc3)N(C)C
LogP: 5.9 · 5.9
NIST: P,p',p''-methylidynetris(n,n-dimethylaniline)(603-48-5)
EPA: Leucogentian violet (603-48-5)

화학적 성질

lavender-coloured powder

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 33.9% (56 of 165) of reports.

Warning

H315 (24.2%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (24.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (23.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400 (41.2%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (41.2%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 165 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 56 of 165 reports by companies.；There are 8 notifications provided by 109 of 165 reports by companies with hazard statement code(s).；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 Information · 4건

Chemical: Benzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-

Hazard Traits - Bioaccumulation; Environmental Persistence；Authoritative List - Canada PBiTs；Report - if used as a fragrance or flavor ingredient

Status: Active Update: 11-11-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/22898

Benzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummarySee Gentian Violet.

Hazard Classes and CategoriesSkin Irrit. 2 (24.2%)；Eye Irrit. 2 (24.8%)；STOT SE 3 (23.6%)；Aquatic Acute 1 (41.2%)；Aquatic Chronic 1 (41.2%)

독성 정보

Carcinogen Classification · 5건

Leucogentian violet

Group 3: Not classifiable as to its carcinogenicity to humans

Volume 129: (2022) Gentian Violet, Leucogentian Violet, Malachite Green, Leucomalachite Green, and CI Direct Blue 218

2022 online

2021

규제 정보

Regulatory Information · 4건

Chemical: Benzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-

Hazard Traits - Bioaccumulation; Environmental Persistence；Authoritative List - Canada PBiTs；Report - if used as a fragrance or flavor ingredient

Status: Active Update: 11-11-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/22898

Benzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 32041990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
기존화학 물질: KE-34803
Hazard Classifications: Aquatic Acute 1Aquatic Chronic 1
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

UsesUsed as a precursor of gentian violet; Also used as a chromogenic reagent for several applications; [IARC]

General Manufacturing InformationBenzenamine, 4,4',4''-methylidynetris[N,N-dimethyl-: ACTIVE

상·하류 제품 정보

하류 제품

4,4'-Bis(dimethylamino)thiobenzophenone

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

연결된 노트

불러오는 중…

Leucocrystal Violet

기본 정보