N-(2-아미노에틸)-N-[5-(트리플루오로메틸)피리딘-2-일]아민

(2-Aminoethyl)[5-(trifluoromethyl)(2-pyridyl)]amine

HCID 2779424CAS 207557-34-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: NCCNc1ccc(C(F)(F)F)cn1
InChIKey: PFGNVKSFFSSFEU-UHFFFAOYSA-N
분자식: C8H10F3N3
평균 분자량: 205.18 g/mol
단동위원소 질량: 205.08268198

이름 및 식별자

우선 이름: (2-Aminoethyl)[5-(trifluoromethyl)(2-pyridyl)]amine
IUPAC: N'-[5-(trifluoromethyl)-2-pyridinyl]ethane-1,2-diamine
현지명: N-(2-아미노에틸)-N-[5-(트리플루오로메틸)피리딘-2-일]아민
영어명: N-(2-aminoethyl)-N-[5-(trifluoromethyl)pyridin-2-yl]amine
분자식: C8H10F3N3
분자량: 205.18

이름 및 동의어

207557-34-4(2-aminoethyl)[5-(trifluoromethyl)(2-pyridyl)]amineDTXSID30381435RefChem:395368DTXCID10332460N1-[5-(Trifluoromethyl)pyridin-2-yl]ethane-1,2-diamineN'-[5-(trifluoromethyl)pyridin-2-yl]ethane-1,2-diamineMFCD008165921,2-Ethanediamine, N1-[5-(trifluoromethyl)-2-pyridinyl]-C8H10F3N31-(5-Trifluoromethyl-pyridin-2-yl)-ethane-1,2-diamineN'-[5-(trifluoromethyl)-2-pyridyl]ethane-1,2-diamine

이름 더 보기

N-(2-아미노에틸)-N-[5-(트리플루오로메틸)피리딘-2-일]아민N-(2-aminoethyl)-N-[5-(trifluoromethyl)pyridin-2-yl]amine

N1-(5-(trifluoromethyl)pyridin-2-yl)ethane-1,2-diamineN-(2-Aminoethyl)-N-[5-(trifluoromethyl)-pyridin-2-yl]amineSCHEMBL50936621,2-Ethanediamine, N-[5-(trifluoromethyl)-2-pyridinyl]-PFGNVKSFFSSFEU-UHFFFAOYSA-NPFGNVKSFFSSFEU-UHFFFAOYSA-OHIA55734SBB093459

데이터베이스 식별자

CAS: 207557-34-4
PubChem CID: 2779424
DTXSID: DTXSID30381435
EC Number: 106-772-6

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 50.9 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 6
회전 가능 결합 수: 3
무거운 원자 수: 14
형식 전하: 0
복잡도: 172

물리화학적 성질

끓는 점: 291.4 · 291.4±40.0 °C(Predicted)
밀도: 1.316 · 1.316±0.06 g/cm3(Predicted)
산도 계수 (pKa): 9.08 · 9.08±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P272, P280, P301+P316, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.