글루타콘디아닐염산염

N-(5-(phenylamino)penta-2,5-dienylidene)aniline monohydrochloride

HCID 73902

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1497-49-0
표준 SMILES: C(=CC=Nc1ccccc1)C=CNc1ccccc1.Cl
InChIKey: VUCMMJBDNXZQDJ-UHFFFAOYSA-N
분자식: C17H17ClN2
평균 분자량: 284.8 g/mol
단동위원소 질량: 284.10802622

이름 및 식별자

우선 이름: N-(5-(phenylamino)penta-2,5-dienylidene)aniline monohydrochloride
IUPAC: N-(5-phenyliminopenta-1,3-dienyl)aniline;hydrochloride
현지명: 글루타콘디아닐염산염
영어명: Glutacondianil hydrochloride
분자식: C17H17ClN2
분자량: 284.78

이름 및 동의어

N-(5-(Phenylamino)penta-2,5-dienylidene)aniline monohydrochlorideN-[5-(phenylamino)penta-2,5-dienylidene]aniline monohydrochlorideRefChem:828019Glutacondianil hydrochloridePentadienedianiline hydrochloride6L65XPG9ERGlutaconaldehyde dianilide hydrochlorideDTXSID7044398Indocyanine Green Impurity 14Glutaconic aldehyde dianilide (hydrochloride)N-((1E,3E,5E)-5-(phenylimino)penta-1,3-dien-1-yl)aniline hydrochlorideGlutaconaldehyde dianil chloride

이름 더 보기

글루타콘디아닐염산염GLUTACONDIANIL HCLGLUTACONIC ALDEHYDE DIANILIDE HYDROCHLORIDEGLUTACONDIALDEHYDE HCLGlutacondialdehydeDianilHClIndocyanine Green Impurity 2 HCl

N-(5-phenyliminopenta-1,3-dienyl)aniline;hydrochlorideN-(5-(Phenylimino)penta-1,3-dien-1-yl)aniline hydrochlorideN-[5-(Phenylimino)-1,3-pentadien-1-yl]aniline hydrochloride (1:1)Benzenamine, N-(5-(phenylamino)-2,4-pentadienylidene)-, monohydrochlorideBenzenamine, N-[5-(phenylamino)-2,4-pentadienylidene]-, monohydrochlorideN-[(1E,3E,5E)-5-(PHENYLIMINO)PENTA-1,3-DIEN-1-YL]ANILINE HYDROCHLORIDEN-[5-(Phenylamino)-2,4-pentadienylidene]aniline monohydrochlorideGlutaconaldehydedianil hydrochloride

데이터베이스 식별자

CAS: 1497-49-0
PubChem CID: 73902
DTXSID: DTXSID7044398
UNII: 6L65XPG9ER
EC Number: 216-094-3

물성

구조 계산 물성

극성 표면적: 24.4 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 20
형식 전하: 0
복잡도: 305

물리화학적 성질

녹는점: 152 °C · 152 °C
저장 조건: Inert atmosphere,Room Temperature
용해도: 클로로포름 (약간 용해됨), DMSO (약간 용해됨)
물리적 상태: 가루
색상: 진한 빨간색에서 보라색까지
수용성: 메탄올에 용해됩니다. 물에 불용성..
BRN: 3916924 · 3916924
안정성: 흡습성
주요 응용: 진단 검사 제조혈액학조직학
InChI: InChI=1S/C17H16N2.ClH/c1-4-10-16(11-5-1)18-14-8-3-9-15-19-17-12-6-2-7-13-17;/h1-15,18H;1H/b9-3+,14-8+,19-15+;
InChIKey: VUCMMJBDNXZQDJ-SAIFEKGMSA-N
SMILES: C1(N/C=C/C=C/C=N/C2C=CC=CC=2)C=CC=CC=1.Cl
EPA: 5 · Benzenamine, N-[5-(phenylamino)-2,4-pentadienylidene]-, monohydrochloride (1497-49-0)

화학적 성질

bordeaux to purple powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 49 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 24-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26083

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29214200
risk_code: 36/37/38-20/21/22
hazard_code: Xn,Xi
safety_code: 36/37/39-26-37/39-24/25
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도Glutacondianil Hydrochloride is used as a reagent in the synthesis of novel vinylsulfone cyanine dyes used for labelling biomolecules. Dyes and metabolites.