3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride

HCID 21976925

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 119812-29-2
표준 SMILES: CN(C)CC1CCc2c(c3ccccc3n2C)C1=O.Cl
InChIKey: GFQLILQFQHMEPF-UHFFFAOYSA-N
분자식: C16H21ClN2O
평균 분자량: 292.8 g/mol
단동위원소 질량: 292.13424097

이름 및 식별자

우선 이름: 3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride
IUPAC: 3-[(dimethylamino)methyl]-9-methyl-2,3-dihydro-1H-carbazol-4-one;hydrochloride
영어명: 3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride
분자식: C16H21ClN2O
분자량: 292.81

이름 및 동의어

3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride4H-Carbazol-4-one, 3-[(dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-, hydrochloride (1:1)EC 601-635-13-((Dimethylamino)methyl)-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride4H-Carbazol-4-one, 3-((dimethylamino)methyl)-1,2,3,9-tetrahydro-9-methyl-, hydrochloride (1:1)RefChem:488801601-635-1658-038-4119812-29-23-((Dimethylamino)methyl)-9-methyl-2,3-dihydro-1H-carbazol-4(9H)-one hydrochlorideMFCD008002313-[(dimethylamino)methyl]-9-methyl-2,3-dihydro-1H-carbazol-4-one;hydrochloride

이름 더 보기

Fenazaquin Impurity 8Ondansetron Related CoMpound AOndansetron impurity A (PhEur)Ondansetron Related Compound A (USP)Ondansetron Impurity 1 HydrochlorideOndansetron Impurity A(Hydrochloride)Ondansetron Related Compound A (50 mg)Ondansetron EP Impurity A HCl(USP RC A)Ondansetron HCl EP IMpurity-A (USP RC A)Ondansetron Related Compound A as Hydrochloride

3-((Dimethylamino)methyl)-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one hydrochloride3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazole-4-one hydrochloride3-[(dimethylamino)methyl]-9-methyl-2,3-dihydro-1H-carbazol-4-one hydrochloride3-[(dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4h-carbazole-4-one(3RS)-3-(Dimethylamino)methyl-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one Hydrochloride3-[(dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-oneSCHEMBL5202651DTXSID40621031

데이터베이스 식별자

CAS: 119812-29-2
PubChem CID: 21976925
DTXSID: DTXSID40621031
EC Number: 601-635-1、658-038-4

물성

구조 계산 물성

극성 표면적: 25.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 20
형식 전하: 0
복잡도: 355

물리화학적 성질

저장 조건: 2 · 2-8°C
용해도: 메탄올(약간 용해됨), 물(약간 용해됨)
물리적 상태: solid
BRN: 11612579 · 11612579
주요 응용: 의약품(소분자)
InChI: 1S/C16H20N2O.ClH/c1-17(2)10-11-8-9-14-15(16(11)19)12-6-4-5-7-13(12)18(14)3;/h4-7,11H,8-10H2,1-3H3;1H
InChIKey: GFQLILQFQHMEPF-UHFFFAOYSA-N
SMILES: Cl.CN(C)CC1CCc2c(C1=O)c3ccccc3n2C

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 4.8% (2 of 42) of reports.

Danger

H290 (92.9%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P264, P270, P301+P316, P321, P330, P390, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

유해성 정보

Regulatory InformationStatus: Active Update: 15-02-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/7729

Hazard Classes and Categories · 2건

Met. Corr. 1 (92.9%)

Acute Tox. 4 (100%)

안전 데이터

wgk: 3
ridadr: UN 2923 6.1(8) / PGIII
HS 번호: 2933997500
risk_code: 25
hazard_code: T
safety_code: 45
Hazard Classifications: Acute Tox. 3 OralMet. Corr. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects