4,4'-[(4-메틸-1,3-페닐렌)비스(아조)]비스[6-메틸-1,3-벤젠다이아민]

Bismarck Brown R Base

HCID 24674

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 4482-25-1
표준 SMILES: Cc1cc(N=Nc2ccc(C)c(N=Nc3cc(C)c(N)cc3N)c2)c(N)cc1N
InChIKey: SOJKLCSQJMPLCK-UHFFFAOYSA-N
분자식: C21H24N8
평균 분자량: 388.5 g/mol
단동위원소 질량: 388.2123928

이름 및 식별자

우선 이름: Bismarck Brown R Base
IUPAC: 4-[[3-[(2,4-diamino-5-methylphenyl)diazenyl]-4-methylphenyl]diazenyl]-6-methylbenzene-1,3-diamine
현지명: 4,4'-[(4-메틸-1,3-페닐렌)비스(아조)]비스[6-메틸-1,3-벤젠다이아민]
영어명: 5,5'-[(4-methyl-1,3-phenylene)bis(azo)]bis[toluene-2,4-diamine]
분자식: C21H24N8
분자량: 388.47

이름 및 동의어

Bismarck Brown R BaseDTXSID50634915,5'-[(4-methyl-1,3-phenylene)bis(azo)]bis[toluene-2,4-diamine]5,5'-((4-Methyl-1,3-phenylene)bis(azo))bis(toluene-2,4-diamine)RefChem:569462DTXCID30403584482-25-1Bismarck Brown X BaseBismarck Brown G BaseBismarck Brown Base NSBismarck Brown RX BaseBismarck Brown TSS Base

이름 더 보기

4,4'-[(4-메틸-1,3-페닐렌)비스(아조)]비스[6-메틸-1,3-벤젠다이아민]4,4'-[(4-메틸-1,3-페닐렌)비스(아조)]비스[6-메틸-1,3-벤젠다이아민](염기성갈색4호)및그염류5,5'-[(4-메틸-1,3-페닐렌)비스(아조)]비스[톨루엔-2,4-디아민]Solvent BrownC.I.Solvent Brown 12C.I.Solvent Brown 12:C.I.21010:12,4-Bis(2,4-diamino-5-methylphenylazo)toluene4,4'-[(4-Methyl-1,3-phenylene)bisazo]bis(6-methylbenzene-1,3-diamine)4,4'-(4-Methyl-1,3-phenylenebisazo)bis(6-methyl-1,3-phenylenediamine)1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene) bis(azo)]bis[6-methyl-4,4''-((4-METHYL-1,3-PHENYLENE)BIS(AZO))BIS(6-METHYL-1,3- BENZENEDIAMINE)1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(2,1-d iazenediyl)]bis[6-methyl-

Brasilazina Brown R BaseMLS0007366291,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(azo)]bis[6-methyl-4-[[3-[(2,4-diamino-5-methylphenyl)diazenyl]-4-methylphenyl]diazenyl]-6-methylbenzene-1,3-diamine357RPV4TE1NSC-47722SMR0005282261,3-Benzenediamine, 4,4'-((4-methyl-1,3-phenylene)bis(azo))bis(6-methyl-

데이터베이스 식별자

CAS: 4482-25-1
PubChem CID: 24674
DTXSID: DTXSID5063491
ChEMBL: CHEMBL1602553、CHEMBL1864168
UNII: 357RPV4TE1
EC Number: 224-764-1
Nikkaji: J205.863D

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 154 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 8
회전 가능 결합 수: 4
무거운 원자 수: 29
형식 전하: 0
복잡도: 581

실험 및 물리화학적 성질

CosmeticsHair dyeing

Physical DescriptionWet Solid

물리화학적 성질

끓는 점: 729 · 729.0±60.0 °C(Predicted)
밀도: 1.34 · 1.34±0.1 g/cm3(Predicted)
산도 계수 (pKa): 2.96 · 2.96±0.10(Predicted)
화장품 원료 기능: 머리 염색
EPA: 1 · 1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(azo)]bis[6-methyl- (4482-25-1)

안전 및 규제

GHS 분류

GHS Classification · 6건

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 1 notifications to the ECHA C&L Inventory.

Warning

H351: Suspected of causing cancer [Warning Carcinogenicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 3건

Chemical: 1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(azo)]bis[6-methyl-

1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(2,1-diazenediyl)]bis[6-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(2,1-diazenediyl)]bis[6-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: 5,5'-[(4-methyl-1,3-phenylene)bis(azo)]bis[toluene-2,4-diamine] (EC: 224-764-1)

Other Safety InformationIMAP assessments - Dyes that could release selected carcinogenic amines (listed on AICS): Human health tier II assessment

Hazard Classes and Categories · 2건

Aquatic Chronic 4 (100%)

Carcinogenicity - category 2

안전 데이터

tsca: TSCA listed

화학 및 산업

용도 및 제조

U.S. Production2023: 477,940 lb

Industry UsesDye

Use ClassificationCosmetics -> Hair dyeing

General Manufacturing Information · 2건

Synthetic Dye and Pigment Manufacturing

1,3-Benzenediamine, 4,4'-[(4-methyl-1,3-phenylene)bis(2,1-diazenediyl)]bis[6-methyl-: ACTIVE

제조 방법

2 moles of nitrous acid treatment with 3 moles of 4-Methylbenzene-1,3-diamine hydrochloride.

공급사8 곳

河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]

career henan chemical co+86-0371-86658258 · [email protected]

海蔚化学86-21-51086038 · [email protected]

爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]

XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]

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