CAS 429672-02-6 Tert-butyl 3-azidoazetidine-1-carboxylate (HCID 22242836)

基本情報

CAS: 429672-02-6
標準SMILES: CC(C)(C)OC(=O)N1CC(N=[N+]=[N-])C1
InChIKey: ZHQJKBCCOFSQEM-UHFFFAOYSA-N
分子式: C8H14N4O2
平均分子量: 198.22 g/mol

名称と識別子

優先名称: Tert-butyl 3-azidoazetidine-1-carboxylate
IUPAC: tert-butyl 3-azidoazetidine-1-carboxylate
英語名: 1-Boc-3-azido-azetidine
分子式: C8H14N4O2
分子量: 198.22236

名称と別名

429672-02-6tert-butyl 3-azidoazetidine-1-carboxylate1-Boc-3-azido-azetidine1-boc-3-azidoazetidineMFCD196862773-Azido-1-Boc-azetidine3-Azido-azetidine-1-carboxylic Acid tert-butyl EsterSCHEMBL13621520ZHQJKBCCOFSQEM-UHFFFAOYSA-NESA672023-azido-1-(t-butoxycarbonyl)azetidineAKOS026706192

名称をさらに表示

tert-butyl 3-azidoazetidine-1-carboxylate - [A4532]1-Azetidinecarboxylic acid, 3-azido-, 1,1-dimethylethyl este...

AB915023-azido-1-(t-butoxycarbonyl)-azetidineSY189498DB-087120EN300-81032F542076F1907-0047

データベース識別子

CAS: 429672-02-6
PubChem CID: 22242836
EC Number: 119-091-4

物性

構造計算による物性

XLogP: 1.8
極性表面積: 43.9 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 3
重原子数: 14
形式電荷: 0
複雑度: 272

物理化学的性質

貯蔵温度: 0 · Store at 0-8 °C

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H240 (100%): Heating may cause an explosion [Danger Self-reactive substances and mixtures; Organic peroxides]

P203, P210, P234, P235, P240, P260, P261, P264, P271, P280, P301+P316, P302+P352, P304+P340, P318, P319, P321, P331, P332+P317, P362+P364, P370+P372+P380+P373, P403, P403+P233, P405, P410, P411, P420, 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.