CAS 442199-19-1 tert-Butyl 4-[(6-chloropyrimidin-4-yl)oxy]piperidine-1-carboxylate (HCID 21906116)

기본 정보

CAS: 442199-19-1
표준 SMILES: CC(C)(C)OC(=O)N1CCC(Oc2cc(Cl)ncn2)CC1
InChIKey: OJIDDXUJOFGRCN-UHFFFAOYSA-N
분자식: C14H20ClN3O3
평균 분자량: 313.78 g/mol
단동위원소 질량: 313.11931918

이름 및 식별자

우선 이름: tert-Butyl 4-[(6-chloropyrimidin-4-yl)oxy]piperidine-1-carboxylate
IUPAC: tert-butyl 4-(6-chloropyrimidin-4-yl)oxypiperidine-1-carboxylate
영어명: 4-(6-Chloro-pyriMidin-4-yloxy)-piperidine-1-carboxylic acid tert-butyl ester, 98+% C14H20ClN3O3, MW: 313.78
분자식: C14H20ClN3O3
분자량: 313.78

이름 및 동의어

442199-19-1tert-Butyl 4-((6-chloropyrimidin-4-yl)oxy)piperidine-1-carboxylatetert-butyl 4-[(6-chloropyrimidin-4-yl)oxy]piperidine-1-carboxylateDTXSID00619853RefChem:383446DTXCID50570607891-093-44-(6-Chloro-pyrimidin-4-yloxy)-piperidine-1-carboxylic acid tert-butyl estertert-butyl 4-(6-chloropyrimidin-4-yl)oxypiperidine-1-carboxylateMFCD09607595SCHEMBL1066568OJIDDXUJOFGRCN-UHFFFAOYSA-N

이름 더 보기

4-(6-Chloro-pyrimidin-4-yloxy)-piperidine-1-Carbocylic acid tert-butyl ester1-Piperidinecarboxylic acid, 4-[(6-chloro-4-pyrimidinyl)oxy]-, 1,1-dimethylethyl ester4-(6-Chloro-pyriMidin-4-yloxy)-piperidine-1-carboxylic acid tert-butyl ester, 98+% C14H20ClN3O3, MW: 313.78

SSA19919tert-butyl 4-(6-chloropyrimidin-4-yloxy)piperidine-1-carboxylateSBB075193AKOS015941058DB-070520G53388EN300-26072192tert-butyl 4-(6-chloropyrimidin-4-yloxy)piperidinecarboxylate

데이터베이스 식별자

물성

구조 계산 물성

XLogP: 2.9
극성 표면적: 64.6 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 4
무거운 원자 수: 21
형식 전하: 0
복잡도: 354

물리화학적 성질

밀도: 1.242 · 1.242
저장 조건: 2 · 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, 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.