CAS 38212-30-5 1-(4-Methoxyphenyl)piperazine (HCID 269722)

개요

a designer drug; structure in first source

이름 및 식별자

우선 이름: 1-(4-Methoxyphenyl)piperazine
IUPAC: 1-(4-methoxyphenyl)piperazine
현지명: 1-(4-메톡시페닐)피페라진
영어명: 1-(4-Methoxyphenyl)piperazine
분자식: C11H16N2O
분자량: 192.26

이름 및 동의어

1-(4-Methoxyphenyl)piperazine38212-30-5N-(p-methoxyphenyl)piperazineP385M92GYGJ231.894FDTXSID30191591RefChem:828535DTXCID70114082253-829-7n-(4-methoxyphenyl)piperazinePiperazine, 1-(4-methoxyphenyl)-MFCD00040736

이름 더 보기

1-(4-메톡시페닐)피페라진1-(4-anisyl)piperazineTIMTEC-BB SBB003292Miconazole Impurity 211-paramethoxyphenylazine4-(4-Methoxyphenyl)piperazine1-(4-Methoxyphenyl) piperazine-S1-(4-Methoxyphenyl)piperazine,96%

1-(4-methoxyphenyl)-piperazine4-methoxyphenylpiperazineUNII-P385M92GYGEINECS 253-829-7Posaconazole Impurity MPPACHEMBL595171-(4-Methoxy-phenyl)-piperazinePARA-METHOXYPHENYLPIPERAZINE

데이터베이스 식별자

CAS: 38212-30-5
PubChem CID: 269722
DTXSID: DTXSID30191591
ChEMBL: CHEMBL59517
UNII: P385M92GYG
EC Number: 253-829-7
Nikkaji: J231.894F

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 24.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 161

실험 및 물리화학적 성질

Drugs · 2건

DEA NFLIS-Drug Category -> Piperazines (Hallucinogen)

Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

Collision Cross Section141.9 Å² [M+H]+ [CCS Type: TW; Method: Major Mix IMS/Tof Calibration Kit (Waters)]

물리화학적 성질

녹는점: 42 · 42-47 °C (lit.)
끓는 점: 130 °C · 130 °C
밀도: 1.0529 · 1.0529 (rough estimate)
굴절률: 1.575 · 1.5750 (estimate)
인화점: 230 °F · >230 °F
저장 조건: -20 °C · -20°C Freezer
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 8.98 · 8.98±0.10(Predicted)
물리적 상태: 결정질 저융점 고체
색상: 밝은 노란색에서 호박색까지
수용성: 물, 메탄올 및 톨루엔에 용해됨
BRN: 156736 · 156736
InChI: 1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
InChIKey: MRDGZSKYFPGAKP-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)N2CCNCC2

화학적 성질

light yellow to amber cryst. low melting solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): 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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationPiperazine, 1-(4-methoxyphenyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29335990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36-28A
F 고인화성물질: 10-34
위험 참고 사항: Irritant
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

약리 정보

Metabolism/Metabolites1-(4-methoxyphenyl)piperazine has known human metabolites that include 1-(4-hydroxyphenyl)piperazine.

응용 분야

용도It is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuffs.

상·하류 제품 정보

상류 원료

하류 제품

1-(4-아미노페닐)-4-(4-히드록시페닐)피페라진 2,4-DIHYDRO-4-[(4-(4-HYDROXYPHENYL)-1-PIPERAZINYL)PHENYL]-2-(1-METHYLPROPYL)-3H-1,2,4-TRIAZOLE-3-ONE 2-CHLORO-1-[4-(4-METHOXY-PHENYL)-PIPERAZIN-1-YL]-ETHANONE 2-[4-(4-METHOXYPHENYL)PIPERAZINO]-1-PHENYL-1-ETHANONE 4-피페라지노페놀디하이드로브로마이드 이소프로필이트라코나졸

공급사100 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

上海策嵘生物科技有限公司[email protected]

济南百隆化学有限公司[email protected] · [email protected]

广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]

普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

화합물 노트

불러오는 중…

1-(4-메톡시페닐)피페라진

기본 정보

개요