8-아자비시클로[3.2.1]옥탄염산염

8-Azabicyclo[3.2.1]octane hydrochloride

HCID 522272

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 6760-99-2
표준 SMILES: C1CC2CCC(C1)N2.Cl
InChIKey: VAINBTSWOOHLOV-UHFFFAOYSA-N
분자식: C7H14ClN
평균 분자량: 147.64 g/mol
단동위원소 질량: 147.0814771

이름 및 식별자

우선 이름: 8-Azabicyclo[3.2.1]octane hydrochloride
IUPAC: 8-azabicyclo[3.2.1]octane;hydrochloride
현지명: 8-아자비시클로[3.2.1]옥탄염산염
영어명: 8-Azabicyclo[3.2.1]octane hydrochloride
분자식: C7H14ClN
분자량: 147.64576

이름 및 동의어

8-azabicyclo[3.2.1]octane hydrochloride6760-99-2DTXSID303349068-azabicyclo(3.2.1)octane hydrochlorideRefChem:311748DTXCID40285995816-943-38-Azabicyclo[3.2.1]octane, hydrochloride8-aza-bicyclo[3.2.1]octane hydrochlorideMFCD199825618-Azabicyclo[3.2.1]octane HCl8-azabicyclo[3.2.1]octane;hydrochloride

이름 더 보기

8-아자비시클로[3.2.1]옥탄염산염8-Azabicyclo[3.2.1]octane hydrochloride 95+%8-azabiscyclo[3.2.1]octylalkanehydrochloride8-Azabicyclo[3.2.1]octane, hydrochloride (1:1)

SCHEMBL1955818VAINBTSWOOHLOV-UHFFFAOYSA-NAKOS024463995DS-7448SB100898-azabicyclo[3.2.1]octanehydrochlorideSY097135DB-264167

데이터베이스 식별자

CAS: 6760-99-2
PubChem CID: 522272
DTXSID: DTXSID30334906
EC Number: 816-943-3

물성

구조 계산 물성

극성 표면적: 12 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 80

물리화학적 성질

녹는점: 307 · 307-308 °C
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
InChI: InChI=1S/C7H13N.ClH/c1-2-6-4-5-7(3-1)8-6;/h6-8H,1-5H2;1H
InChIKey: VAINBTSWOOHLOV-UHFFFAOYSA-N
SMILES: C12NC(CC1)CCC2.[H]Cl

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

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, 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 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.