1-FLUORO-4-HYDROXY-1,4-DIAZONIABICYCLO[2.2.2]옥탄비스(테트라플루오로붕산염)

1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)

HCID 2737329

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 162241-33-0
표준 SMILES: F[B-](F)(F)F.F[B-](F)(F)F.O[N+]12CC[N+](F)(CC1)CC2
InChIKey: DRMMNFGYCLJZKD-UHFFFAOYSA-N
분자식: C6H13B2F9N2O
평균 분자량: 321.79 g/mol
단동위원소 질량: 322.1070268

이름 및 식별자

우선 이름: 1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)
IUPAC: 1-fluoro-4-hydroxy-1,4-diazoniabicyclo[2.2.2]octane ditetrafluoroborate
현지명: 1-FLUORO-4-HYDROXY-1,4-DIAZONIABICYCLO[2.2.2]옥탄비스(테트라플루오로붕산염)
영어명: 1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)
분자식: C6H13B2F9N2O
분자량: 321.79

이름 및 동의어

162241-33-01-FLUORO-4-HYDROXY-1,4-DIAZONIABICYCLO[2.2.2]OCTANE BIS(TETRAFLUOROBORATE)172090-26-51-Fluoro-4-hydroxy-1,4-diazabicyclo[2.2.2]octane-1,4-diium tetrafluoroborate1-fluoro-4-hydroxy-1,4-diazoniabicyclo[2.2.2]octane;ditetrafluoroborate1-fluoro-4-hydroxy-1,4-diazabicyclo[2.2.2]octane-1,4-diium; bis(tetrafluoroboranuide)AccufluorNFThAccufluor; Accufluor NFThSCHEMBL561010DTXSID10371995Q2643325

이름 더 보기

1-FLUORO-4-HYDROXY-1,4-DIAZONIABICYCLO[2.2.2]옥탄비스(테트라플루오로붕산염)ACCUFLUOR(TM)4-fluoro-1-hydroxy-1,4-diazoniabicyclo[2.2.2]octane1-fluoro-4-hydroxy-1,4-diazoniabicyclo-octane bis(bf4)1-FLUORO-4-HYDROXY-1,4-DIAZONIABICYCLO-O CTANE BIS(BF4) ON AN-FLUORO-N'-HYDROXYTRIETHYLENEDIAMMONIUM BIS(TETRAFLUOROBORATE)4-Hydroxy-1-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)1-FLUORO-4-HYDROXY-1,4-DIAZABICYCLO[2.2.2]OCTANE-1,4-DIIUM DITETRAFLUOROBORATE1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2,2,2]octane bis(tetrafluoroborate) on aluminum oxide

1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2,2,2]octane bis(tetrafluoroborate)1-Fluoro-4-hydroxy-1,4-diazoniabicyclo[2,2,2]octanebis(tetrafluoroborate)1-Fluoro-4-hydroxy-1,4-diazabicyclo[2.2.2]octane-1,4-diium bis[tetrafluoridoborate(1-)]1-fluoro-4-hydroxy-1,4-diazoniabicyclo-[2.2.2]octane bis(tetrafluoroborate)1-hydroxyl-4-fluoro- 1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)1-hydroxyl-4-fluoro-1,4-diazoniabicyclo [2.2.2]octane bis(tetrafluoroborate)1-hydroxyl-4-fluoro-1,4-diazoniabicyclo[2.2.2 ]octane bis(tetrafluoroborate)1-hydroxyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate)

데이터베이스 식별자

CAS: 162241-33-0、172090-26-5
PubChem CID: 2737329
DTXSID: DTXSID10371995
EC Number: 629-003-0、803-259-5

물성

구조 계산 물성

극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 12
회전 가능 결합 수: 0
무거운 원자 수: 20
형식 전하: 0
복잡도: 156

물리화학적 성질

물리적 상태: solid
InChI: 1S/C6H13FN2O.2BF4/c7-8-1-4-9(10,5-2-8)6-3-8;2*2-1(3,4)5/h10H,1-6H2;;/q+2;2*-1
InChIKey: DRMMNFGYCLJZKD-UHFFFAOYSA-N
SMILES: F[B-](F)(F)F.F[B-](F)(F)F.O[N+]12CC[N+](F)(CC1)CC2

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H201 (90.5%): (Deleted) Explosive; mass explosion hazard [Danger Explosives]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]；H400 (90.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (90.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P210, P230, P240, P250, P260, P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P319, P321, P330, P333+P317, P362+P364, P370+P380, P372, P373, P391, P401, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 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.

유해성 정보

Hazard Classes and Categories · 2건

Expl. 1.1 (90.5%)；Acute Tox. 4 (100%)；Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；STOT RE 2 (100%)；Aquatic Acute 1 (90.5%)；Aquatic Chronic 1 (90.5%)

Expl. 1.1 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Skin Sens. 1 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

안전 데이터

wgk: 3
risk_code: 22-36/37/38-43
hazard_code: Xn
safety_code: 26-36/37
Hazard Classifications: Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Skin Sens. 1STOT RE 2
스토리지 클래스: 11 - Combustible Solids