1-[4-(메틸술포닐)페닐]피페라진

1-(4-(Methylsulfonyl)phenyl)piperazine

HCID 735904

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 187669-60-9
표준 SMILES: CS(=O)(=O)c1ccc(N2CCNCC2)cc1
InChIKey: KNQFDOLIXOOIGX-UHFFFAOYSA-N
분자식: C11H16N2O2S
평균 분자량: 240.32 g/mol
단동위원소 질량: 240.09324875

이름 및 식별자

우선 이름: 1-(4-(Methylsulfonyl)phenyl)piperazine
IUPAC: 1-(4-methylsulfonylphenyl)piperazine
현지명: 1-[4-(메틸술포닐)페닐]피페라진
영어명: 1-[4-(METHYLSULFONYL)PHENYL]PIPERAZINE
분자식: C11H16N2O2S
분자량: 240.32

이름 및 동의어

1-[4-(methylsulfonyl)phenyl]piperazine1-(4-(methylsulfonyl)phenyl)piperazineRefChem:424466674-407-2187669-60-91-(4-methylsulfonylphenyl)piperazine1-(4-methanesulfonylphenyl)piperazinePiperazine,1-[4-(methylsulfonyl)phenyl]-MFCD036486011-(4-methanesulfonyl-phenyl)-piperazine1-[4-(methylsulphonyl)phenyl]piperazineMixCom4_000241

이름 더 보기

1-[4-(메틸술포닐)페닐]피페라진IDI1_0019851-(4-mesylphenyl)piperazine1-(4-methylsulfonylphenyl)azine1-(4-Methylsulfonyl)phenyl]piperizineMethyl 4-(piperazin-1-yl)phenyl sulphone1-[4-(Methylsulphonyl)phenyl]piperazine 95+%

US7Peakdale2_000513Piperazine, 1-[4-(methylsulfonyl)phenyl]-SCHEMBL532144CHEMBL4543970DTXSID20352876KNQFDOLIXOOIGX-UHFFFAOYSA-NBDBM496663

데이터베이스 식별자

CAS: 187669-60-9
PubChem CID: 735904
DTXSID: DTXSID20352876
ChEMBL: CHEMBL4543970
EC Number: 674-407-2

물성

구조 계산 물성

XLogP: 0.4
극성 표면적: 57.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 16
형식 전하: 0
복잡도: 309

물리화학적 성질

녹는점: 136 · 136~138℃
끓는 점: 136 · 136~138℃
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: 고체
색상: 하얀색

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.