CAS 1837-57-6 Ethacridine Lactate (HCID 15789)

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기본 정보

CAS: 1837-57-6
표준 SMILES: CC(O)C(=O)O.CCOc1ccc2nc3cc(N)ccc3c(N)c2c1
InChIKey: IYLLULUTZPKQBW-UHFFFAOYSA-N
분자식: C18H21N3O4
평균 분자량: 343.4 g/mol
단동위원소 질량: 343.15320616

개요

Acrinol is an organic molecular entity.

이름 및 식별자

우선 이름: Ethacridine Lactate
IUPAC: 7-ethoxyacridine-3,9-diamine;2-hydroxypropanoic acid
현지명: 6,9-DIAMINO-2-ETHOXYACRIDINE젖산
영어명: 6,9-Diamino-2-ethoxyacridine lactate
분자식: C18H21N3O4
분자량: 343.38

이름 및 동의어

ETHACRIDINE LACTATE1837-57-6acrinolRivanol6,9-Diamino-2-ethoxyacridine lactateMetifexRimaonVucineEthodinAntidiar 200ETHACRIDINE LACTATE ANHYDROUSNSC-36333

이름 더 보기

6,9-DIAMINO-2-ETHOXYACRIDINE젖산Acrinol HydrateC12677LevanoACRYNOL

7T7T2I9823DTXSID10872472Neo ChinosolLactate, EthacridineRefChem:921193DTXCID00820129217-408-1642-272-9

데이터베이스 식별자

CAS: 1837-57-6、6402-23-9
PubChem CID: 15789
DTXSID: DTXSID10872472
ChEMBL: CHEMBL2355915、CHEMBL582355
ChEBI: CHEBI:31172
UNII: 7T7T2I9823
EC Number: 217-408-1、642-272-9

물성

구조 계산 물성

극성 표면적: 132 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 7
회전 가능 결합 수: 3
무거운 원자 수: 25
형식 전하: 0
복잡도: 371

실험 및 물리화학적 성질

Collision Cross Section156.3 Å² [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점: 235 °C · 235°C
끓는 점: 478.66 °C · 478.66°C (rough estimate)
밀도: 1.2764 · 1.2764 (rough estimate)
굴절률: 1.5855 · 1.5855 (estimate)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
용해도: 84.5 · DMSO:84.5(Max Conc. mg/mL);246.08(Max Conc. mM)Water:69.0(Max Conc. mg/mL);104.84(Max Conc. mM)
물리적 상태: 고체
색상: 연한 노란색에서 밝은 노란색까지
InChI: InChI=1S/C15H15N3O.C3H6O3/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13;1-2(4)3(5)6/h3-8H,2,16H2,1H3,(H2,17,18);2,4H,1H3,(H,5,6)
InChIKey: IYLLULUTZPKQBW-UHFFFAOYSA-N
SMILES: C12C=C(C=CC1=NC1=CC(N)=CC=C1C=2N)OCC.C(O)(C)C(=O)O
EPA: Rivanol (1837-57-6)

화학적 성질

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.5% (2 of 79) of reports.

Warning

H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]

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 79 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

유해성 정보

Regulatory InformationREACH registered substance: Ethacridine lactate (EC: 217-408-1)

Other Safety InformationIMAP assessments - Propanoic acid, 2-hydroxy-, compound with 7-ethoxy-3,9-acridinediamine (1:1): Environment tier I assessment

Hazard Classes and Categories · 2건

Skin Irrit. 2 (97.5%)

Skin Irrit. 2 (97.8%)

안전 데이터

tsca: TSCA listed
기존화학 물질: KE-20853

화학 및 산업

약리 정보

ATC Code · 4건

D - Dermatologicals

B - Blood and blood forming organs

QD - Dermatologicals

QB - Blood and blood forming organs

MeSH Pharmacological ClassificationSubstances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.

용도 및 제조

General Manufacturing InformationPropanoic acid, 2-hydroxy-, compd. with 7-ethoxy-3,9-acridinediamine (1:1): INACTIVE

응용 분야

용도Bactericide, surgical antisepsis, preparation of pure γ-globulin.

상·하류 제품 정보

상류 원료

모노에틸렌글리콜 포스포러스옥시클로라이드

공급사100 곳

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

화합물 노트

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