ビニルカルバミン酸TERT-ブチル

tert-butyl N-ethenylcarbamate

HCID 251740

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 7150-72-3
標準SMILES: C=CNC(=O)OC(C)(C)C
InChIKey: SJDWKAHMQWSMPV-UHFFFAOYSA-N
分子式: C7H13NO2
平均分子量: 143.18 g/mol
単同位体質量: 143.09462866

名称と識別子

優先名称: tert-butyl N-ethenylcarbamate
IUPAC: tert-butyl N-ethenylcarbamate
現地名: ビニルカルバミン酸TERT-ブチル
英語名: tert-butyl N-ethenylcarbamate
分子式: C7H13NO2
分子量: 143.18

名称と別名

tert-butyl N-ethenylcarbamateRefChem:896400837-672-7tert-butyl vinylcarbamate7150-72-3N-Boc-vinylamineMFCD00081075TERT-BUTYL N-VINYLCARBAMATEtert-butyl ethenylcarbamate28497-66-7tert-ButylvinylcarbamateCarbamic acid, ethenyl-, 1,1-dimethylethyl ester

名称をさらに表示

ビニルカルバミン酸TERT-ブチルSKL171N-BOC Ethyleneaminet-butyl N-vinylcarbamateN-ethyleneylaminomacetic acidtertbutyl esterCarbamic acid, N-ethenyl-, 1,1-dimethylethyl ester

NSC72468N-vinyl-carbamic acid tert-butyl esterN-vinyl t-butylcarbamateTert.-butyl N-vinylcarbamateSCHEMBL1140993SCHEMBL4774889DTXSID90291021SJDWKAHMQWSMPV-UHFFFAOYSA-N

データベース識別子

CAS: 7150-72-3
PubChem CID: 251740
DTXSID: DTXSID90291021
EC Number: 837-672-7
Nikkaji: J801.205I

物性

構造計算による物性

XLogP: 1.4
極性表面積: 38.3 Å²
水素結合供与体数: 1
水素結合受容体数: 2
回転可能結合数: 3
重原子数: 10
形式電荷: 0
複雑度: 135

物理化学的性質

融点: 65 · 65-67 °C(Solv: ethyl acetate (141-78-6); pentane (109-66-0))
沸点: 169.4 · 169.4±13.0 °C(Predicted)
比重(密度): 0.944 · 0.944±0.06 g/cm3(Predicted)
貯蔵温度: -20 °C · Sealed in dry,Store in freezer, under -20°C
外見: solid
酸解離定数(Pka): 11.25 · 11.25±0.46(Predicted)
色: White

安全と法規制

GHS分類

GHS Classification · 5 件

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.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

hs_code: 2924297099

化学と産業

上流・下流製品情報

上流原料

サプライヤー81 社

河南萨克斯生物科技有限公司13803717460 · [email protected]

苏州道澜生物医药科技有限公司15952404857 · [email protected]

南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]

化合物ノート

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