1-메틸-1,2,3,4-테트라히드로-퀴녹살린디히드로클로라이드

1-Methyl-1,2,3,4-tetrahydroquinoxaline

HCID 215850

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 36438-97-8
표준 SMILES: CN1CCNc2ccccc21
InChIKey: SXLZJUPRTINRQQ-UHFFFAOYSA-N
분자식: C9H12N2
평균 분자량: 148.2 g/mol
단동위원소 질량: 148.10004839

이름 및 식별자

우선 이름: 1-Methyl-1,2,3,4-tetrahydroquinoxaline
IUPAC: 4-methyl-2,3-dihydro-1H-quinoxaline
현지명: 1-메틸-1,2,3,4-테트라히드로-퀴녹살린디히드로클로라이드
영어명: 1-METHYL-1,2,3,4-TETRAHYDRO-QUINOXALINE DIHYDROCHLORIDE
분자식: C9H12N2
분자량: 148.21

이름 및 동의어

1-methyl-1,2,3,4-tetrahydroquinoxaline36438-97-8DTXSID70957774RefChem:433661DTXCID001385702805-460-34-methyl-2,3-dihydro-1H-quinoxalineMFCD01684957BRN 0131438Quinoxaline, 1,2,3,4-tetrahydro-1-methyl-Quinoxaline, 1,2,3,4-tetrahydro-4-methyl-Quinoxaline, 1-methyl-1,2,3,4-tetrahydro-

이름 더 보기

1-메틸-1,2,3,4-테트라히드로-퀴녹살린디히드로클로라이드1-METHYL-1,2,3,4-TETRAHYDRO-QUINOXALINE DIHYDROCHLORIDE1-Methyl-1,2,3,4-tetrahydroquinoxaline dihydrochloride, 95+%4-methyl-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine dihydrochloride1-METHYL-1,2,3,4-TETRAHYDRO-QUINOXALINE DIHYDROCHLORIDE ISO 9001：2015 REACH

1-methyl-1,2,3,4-tetrahydro-quinoxalineSCHEMBL305967SCHEMBL6198063SCHEMBL6198065CHEMBL5185429SCHEMBL18228459SCHEMBL28833094SCHEMBL30463209

데이터베이스 식별자

CAS: 36438-97-8
PubChem CID: 215850
DTXSID: DTXSID70957774
ChEMBL: CHEMBL5185429
EC Number: 805-460-3
Nikkaji: J48.375C

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 136

물리화학적 성질

녹는점: 40.5 · 40.5-42℃
끓는 점: 163 · 163-169 °C(Press: 21 Torr)
밀도: 1.033 · 1.033±0.06 g/cm3(Predicted)
산도 계수 (pKa): 7.41 · 7.41±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.