N-시클로프로필-N-피페리딘-4-YL-3-(트리플루오로메틸)벤젠술폰아미드

N-Cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide

HCID 2773944

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 387350-79-0
표준 SMILES: O=S(=O)(c1cccc(C(F)(F)F)c1)N(C1CCNCC1)C1CC1
InChIKey: NQBHDSLGAKITFX-UHFFFAOYSA-N
분자식: C15H19F3N2O2S
평균 분자량: 348.4 g/mol
단동위원소 질량: 348.11193351

이름 및 식별자

우선 이름: N-Cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide
IUPAC: N-cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide
현지명: N-시클로프로필-N-피페리딘-4-YL-3-(트리플루오로메틸)벤젠술폰아미드
영어명: N-Cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide
분자식: C15H19F3N2O2S
분자량: 348.38

이름 및 동의어

N-cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamideRefChem:829730671-756-2387350-79-0N-Cyclopropyl-N-(4-piperidinyl)-3-(trifluoromethyl)benzenesulfonamideN-cyclopropyl-N-(piperidin-4-yl)-3-(trifluoromethyl)benzenesulfonamideMFCD01568000n-cyclopropyl-n-(piperidin-4-yl)-3-(trifluoromethyl)benzenesulphonamideN-cyclopropyl-N-(piperidin-4-yl)-3-(trifluoromethyl)benzene-1-sulfonamidePeakdale1_001258C15H19F3N2O2SSCHEMBL3485825

이름 더 보기

N-시클로프로필-N-피페리딘-4-YL-3-(트리플루오로메틸)벤젠술폰아미드Benzenesulfonamide, N-cyclopropyl-N-4-piperidinyl-3-(trifluoromethyl)-N-Cyclopropyl-N-(piperidin-4-yl)-3-(trifluoromethyl)benzenesulphonamide 95+%

SCHEMBL3958286HMS521J04DTXSID30378789AKOS015840782PS-7000ST51041756F010570SR-01000387773

데이터베이스 식별자

CAS: 387350-79-0
PubChem CID: 2773944
DTXSID: DTXSID30378789
EC Number: 671-756-2

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 57.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 7
회전 가능 결합 수: 4
무거운 원자 수: 23
형식 전하: 0
복잡도: 508

물리화학적 성질

녹는점: 195 °C · >195°C
끓는 점: 437.9 · 437.9±55.0 °C(Predicted)
밀도: 1.39 · 1.39±0.1 g/cm3(Predicted)
산도 계수 (pKa): 9.67 · 9.67±0.10(Predicted)

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.