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1,1-디메틸-4-페닐피페라지늄요오드

1,1-Dimethyl-4-phenylpiperazinium iodide

HCID 5911
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
54-77-3
표준 SMILES
C[N+]1(C)CCN(c2ccccc2)CC1.[I-]
InChIKey
XFZJGFIKQCCLGK-UHFFFAOYSA-M
분자식
C12H19IN2
평균 분자량
318.2 g/mol
단동위원소 질량
318.0593

개요

1,1-dimethyl-4-phenylpiperazinium iodide is a quaternary ammonium salt, a N-arylpiperazine, a piperazinium salt and an organic iodide salt. It has a role as a nicotinic acetylcholine receptor agonist.

이름 및 식별자

우선 이름
1,1-Dimethyl-4-phenylpiperazinium iodide
IUPAC
1,1-dimethyl-4-phenylpiperazin-1-ium iodide
현지명
1,1-디메틸-4-페닐피페라지늄요오드
영어명
1,1-DIMETHYL-4-PHENYLPIPERAZINIUM IODIDE
분자식
C12H19IN2
분자량
318.2

이름 및 동의어

1,1-Dimethyl-4-phenylpiperazinium iodide54-77-3DMPPDMPP iodideDimethylphenylpiperazinium iodideN,N-Dimethyl-N'-phenylpiperazinium iodide1,1-Dimethyl-4-phenylpiperazine iodideX95H7DRX99NSC-89754CHEBI:4290PIPERAZINIUM, 1,1-DIMETHYL-4-PHENYL-, IODIDE1,1 Dimethyl 4 phenylpiperazine Iodide
이름 더 보기
1,1-디메틸-4-페닐피페라지늄요오드1,1-dimethyl-4-phenylpiperazineiodide1,1-dimethyl-4-phenyl-piperaziniuiodide1-METHYL-4-PHENYLPIPERAZINIUM 1-METHIODIDE1,1-Dimethyl-4-phenylpiperazinium Iodide >1,1-Dimethyl-4-phenylpiperazinium iodide,99%1,1-DIMETHYL-4-PHENYLPIPERAZINIUM IODIDE 99%
RefChem:134372Iodide, DimethylphenylpiperaziniumIodide, 1,1-Dimethyl-4-phenylpiperazine200-213-01,1-dimethyl-4-phenylpiperazin-1-ium1,1-dimethyl-4-phenylpiperazin-1-ium iodide1,1-Dimethyl-4-phenyl-piperazinium iodideDimethyl-4-phenylpiperazium iodide

데이터베이스 식별자

CAS
54-77-3
PubChem CID
5911
DTXSID
DTXSID90968822
ChEMBL
CHEMBL47814
ChEBI
CHEBI:4290
UNII
X95H7DRX99
EC Number
200-213-0

물성

구조 계산 물성

극성 표면적
3.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
15
형식 전하
0
복잡도
173

물리화학적 성질

녹는점
234 · 234-238 °C(lit.)
밀도
1.3965 · 1.3965 (estimate)
저장 조건
20 °C · −20°C
용해도
2 O: · H2O: 21 mg/mL
물리적 상태
가루
색상
하얀색
수용성
2 O: · H2O: 21mg/mL
BRN
3746109 · 3746109
InChI
1S/C12H19N2.HI/c1-14(2)10-8-13(9-11-14)12-6-4-3-5-7-12;/h3-7H,8-11H2,1-2H3;1H/q+1;/p-1
InChIKey
XFZJGFIKQCCLGK-UHFFFAOYSA-M
SMILES
[I-].C[N+]1(C)CCN(CC1)c2ccccc2

화학적 성질

white fine crystalline powder

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Warning

H315 (97.4%): 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (97.4%)

안전 데이터

wgk
3
rtecs
TM3385000
ridadr
2811
HS 번호
29335995
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
포장분류
III
위험 등급
6.1
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Agents that mimic neural transmission by stimulation of the nicotinic receptors on postganglionic autonomic neurons. Drugs that indirectly augment ganglionic transmission by increasing the release or slowing the breakdown of acetylcholine or by non-nicotinic effects on postganglionic neurons are not included here nor are the nonspecific cholinergic agonists.

Drugs that bind to and activate nicotinic cholinergic receptors (RECEPTORS, NICOTINIC). Nicotinic agonists act at postganglionic nicotinic receptors, at neuroeffector junctions in the peripheral nervous system, and at nicotinic receptors in the central nervous system. Agents that function as neuromuscular depolarizing blocking agents are included here because they activate nicotinic receptors, although they are used clinically to block nicotinic transmission.

응용 분야

용도1,1-Dimethyl-4-phenylpiperazinium iodide is nicotinic acetylcholine receptor agonist. Nitrification inhibitor that can potentially increase fertilizer N use efficiency (NUE).

공급사45 곳

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Aladdin Scientific[email protected]
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Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
西宝生物科技(上海)股份有限公司13761246140 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
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