6-메톡시-1,2,3,4-테트라히드로-베타-카르볼린

Pinoline

HCID 1868

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 20315-68-8
표준 SMILES: COc1ccc2[nH]c3c(c2c1)CCNC3
InChIKey: QYMDEOQLJUUNOF-UHFFFAOYSA-N
분자식: C12H14N2O
평균 분자량: 202.25 g/mol
단동위원소 질량: 202.11061307

개요

Pinoline has been reported in Phyllodium pulchellum with data available.

이름 및 식별자

우선 이름: Pinoline
IUPAC: 6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
현지명: 6-메톡시-1,2,3,4-테트라히드로-베타-카르볼린
영어명: 6-METHOXY-1,2,3,4-TETRAHYDRO-BETA-CARBOLINE
분자식: C12H14N2O
분자량: 202.25

이름 및 동의어

20315-68-8pinoline6-methoxytryptoline6-Methoxy-1,2,3,4-tetrahydro-beta-carboline1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-6-methoxy-BR3W85U4GS2,3,4,9-Tetrahydro-6-methoxy-1H-pyrido(3,4-b)indole1H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-6-methoxy-DTXSID301742032,3,4,9-Tetrahydro-6-methoxy-1H-pyrido[3,4-b]indole6-methoxytetrahydronorharmaneRefChem:543755

이름 더 보기

6-메톡시-1,2,3,4-테트라히드로-베타-카르볼린6-meothbEOS-62128AKOS JY20829146-Methoxytetrahydro-b-carboline6-methoxytetrahydro-beta-carboline6-methoxy-1,2,3,4-tetrahydro-β-carboline

6-methoxy-1,2,3,4-tetrahydro beta-carbolineDTXCID50966946-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole6-Methoxy-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole6-MeOthbc6-methoxy-2,3,4,9-tetrahydro-1H-beta-carbolineMFCD000120716-Methoxy-1,2,3,4-tetrahydro-9H-pyrido[3,4b] indole

데이터베이스 식별자

CAS: 20315-68-8
PubChem CID: 1868
DTXSID: DTXSID30174203
ChEMBL: CHEMBL266084
UNII: BR3W85U4GS
EC Number: 633-838-6
Nikkaji: J66.648C

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 37.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 15
형식 전하: 0
복잡도: 234

물리화학적 성질

녹는점: 219 · 219-222 °C(lit.)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature

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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
rtecs: UV0725000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
위험 등급: IRRITANT

화학 및 산업

약리 정보

Metabolism/MetabolitesPinoline has known human metabolites that include 1H,2H,3H,4H,9H-pyrido[3,4]indol-6-ol.

MeSH Pharmacological ClassificationDrugs used to prevent SEIZURES or reduce their severity.

응용 분야

용도6-Methoxy-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole is a stain/dye. Dyes and metabolites.

상·하류 제품 정보

상류 원료

3H-Pyrido[3,4-b]indole, 4,9-dihydro-6-methoxy-tert-butyl 6-methoxy-1,3,4,9-tetrahydro-2H-beta-carboline-2-carboxylate 5-메톡시트립타민 6-METHOXY-1 2 3 4-TETRAHYDRO-9H-PYRIDO-&2,3,4,9-tetrahydro-6-methoxy-1H-pyrido[3,4-b]indol-1-one 5-메톡시트립타민염산염 1-Boc-3-피페리돈 4-Methoxyphenylhydrazine hydrochloride 포르말린 글리옥실산

공급사75 곳

上海康恩博医药科技有限公司17510465506 · [email protected]

广州诚创生物科技有限公司18027266590 · [email protected]

陕西科贝莱药物研发有限公司13119135307 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海炎泽化工有限公司15345144255 19975051755 · [email protected]

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