Anthrimide

HCID 6700CAS 82-22-4

기본 정보

표준 SMILES: O=C1c2ccccc2C(=O)c2c(Nc3cccc4c3C(=O)c3ccccc3C4=O)cccc21
InChIKey: WITKIIIPSSFHST-UHFFFAOYSA-N
분자식: C28H15NO4
평균 분자량: 429.4 g/mol
단동위원소 질량: 429.10010796

이름 및 식별자

우선 이름: Anthrimide
IUPAC: 1-[(9,10-dioxoanthracen-1-yl)amino]anthracene-9,10-dione
영어명: 1,1'-DIANTHRIMIDE
분자식: C28H15NO4
분자량: 429.42

이름 및 동의어

Anthrimide1,1'-Dianthrimide1,1'-IminodianthraquinoneDianthrimide1,1'-Dianthraquinonylamine1,1-Dianthrimid9,10-Anthracenedione, 1,1'-iminobis-Imino-1,1'-bianthraquinoneDi-1,1'-anthrachinonylamin1,1-Dianthrimid [Czech]Bis-(1-anthrachinonyl)aminNSC 7226

이름 더 보기

DIANTHRAQUINONYLAMINE1,1'-DIANTHRIMIDE, 97+%DI(1-ANTHRAQUINOYL)AMINE1,1’-iminodi-anthraquinondi-1,1’-anthrachinonylamin

Bis-(1-anthrachinonyl)amin [Czech]ANTHRAQUINONE, 1,1'-IMINODI-Bis(1-anthraquinonyl)amineEINECS 201-405-7UNII-717ZXC72EADi-1,1'-anthrachinonylamin [Czech]BRN 2607016717ZXC72EA

데이터베이스 식별자

CAS: 82-22-4
PubChem CID: 6700
DTXSID: DTXSID4058865
UNII: 717ZXC72EA
EC Number: 201-405-7
Nikkaji: J4.609D

물성

구조 계산 물성

XLogP: 5.9
극성 표면적: 80.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 2
무거운 원자 수: 33
형식 전하: 0
복잡도: 783

실험 및 물리화학적 성질

Chemical ClassesDyes -> Anthraquinone Dyes

Physical DescriptionDeep red or lustrous coppery red solid; [Merck Index] Dark red powder; [Aldrich MSDS]

물리화학적 성질

녹는점: 300 °C · 300 °C
끓는 점: 544.01 °C · 544.01°C (rough estimate)
밀도: 1.295 · 1.2950 (rough estimate)
굴절률: 1.629 · 1.6290 (estimate)
산도 계수 (pKa): -4.72 · -4.72±0.20(Predicted)
물리적 상태: powder to crystal
색상: Orange to Brown to Dark red
Merck: 14 · 14,690
EPA: 9 · 9,10-Anthracenedione, 1,1'-iminobis- (82-22-4)

화학적 성질

Dark red powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationChemical: 9,10-Anthracenedione, 1,1'-iminobis-

Hazards SummaryA mild skin and eye irritant; [RTECS] May cause irritation; [Aldrich MSDS]

Hazard Classes and CategoriesEye Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: CB7780000
HS 번호: 2922.39.4500
risk_code: 36/37/38
hazard_code: Xi
safety_code: 37/39-26

화학 및 산업

용도 및 제조

UsesUsed for the determination of boron and silicon; [Merck Index]

General Manufacturing Information9,10-Anthracenedione, 1,1'-iminobis-: ACTIVE

응용 분야 · 1건

용도Determination of boron. 1,1'-Dianthrimide is used as a 0.02% solution in Concentrated H2SO4. The olive-green solution turns blue in the presence of boron. The blue solution has an absorption max at 620 nm. Also used in the determination of silicon.