CAS 224161-37-9 6-Fluoro-1,2,3,4-tetrahydroisoquinoline (HCID 15718724)

기본 정보

CAS: 224161-37-9
표준 SMILES: Fc1ccc2c(c1)CCNC2
InChIKey: IGFFEMNFESMQQW-UHFFFAOYSA-N
분자식: C9H10FN
평균 분자량: 151.18 g/mol
단동위원소 질량: 151.07972749

이름 및 식별자

우선 이름: 6-Fluoro-1,2,3,4-tetrahydroisoquinoline
IUPAC: 6-fluoro-1,2,3,4-tetrahydroisoquinoline
현지명: 6-FLUORO-1,2,3,4-테트라하이드로-이소퀴놀린
영어명: 6-FLUORO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE
분자식: C9H10FN
분자량: 151.18

이름 및 동의어

6-FLUORO-1,2,3,4-TETRAHYDROISOQUINOLINE224161-37-9DTXSID50577338RefChem:308319DTXCID10528109817-920-06-FLUORO-1,2,3,4-TETRAHYDRO-ISOQUINOLINEMFCD06739157ISOQUINOLINE, 6-FLUORO-1,2,3,4-TETRAHYDRO-SCHEMBL330372SCHEMBL585671IGFFEMNFESMQQW-UHFFFAOYSA-N

이름 더 보기

6-FLUORO-1,2,3,4-테트라하이드로-이소퀴놀린Isoquinoline, 6-fluoro-1,2,3,4-tetrahydro- (9CI)

AKOS006222517AB28734BS-13546SY148086DB-032365CS-0171031EN300-124372F050272

데이터베이스 식별자

CAS: 224161-37-9
PubChem CID: 15718724
DTXSID: DTXSID50577338
EC Number: 817-920-0
Nikkaji: J3.559.283K

물성

구조 계산 물성

XLogP: 1.4
극성 표면적: 12 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 138

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.