CAS 79201-39-1 N'-cyclopentylidene(tert-butoxy)carbohydrazide (HCID 4058837)

基本情報

CAS: 79201-39-1
標準SMILES: CC(C)(C)OC(=O)NN=C1CCCC1
InChIKey: JIWAYUZEWSSBRC-UHFFFAOYSA-N
分子式: C10H18N2O2
平均分子量: 198.26 g/mol
単同位体質量: 198.13682782

名称と識別子

優先名称: N'-cyclopentylidene(tert-butoxy)carbohydrazide
IUPAC: tert-butyl N-(cyclopentylideneamino)carbamate
英語名: Hydrazinecarboxylic acid, cyclopentylidene-, 1,1-dimethylethyl ester (9CI)
分子式: C10H18N2O2
分子量: 198.26

名称と別名

N'-cyclopentylidene(tert-butoxy)carbohydrazideRefChem:821249898-733-179201-39-1tert-Butyl 2-cyclopentylidenehydrazinecarboxylatetert-butyl N-(cyclopentylideneamino)carbamatetert-Butyl cyclopentylidenecarbazateMFCD00471042tert-Butyl 2-cyclopentylidenehydrazine-1-carboxylateHydrazinecarboxylic acid, cyclopentylidene-, 1,1-dimethylethyl ester (9CI)SCHEMBL573354DTXSID60398874

名称をさらに表示

Hydrazinecarboxylic acid, cyclopentylidene-tert-butyl2-cyclopentylidenehydrazine-1-carboxylateN'-[(1Z)-Cyclopentylidene]-(tert-butoxy)carbohydrazideN'-Cyclopentylidene-hydrazinecarboxylic acid tert-butyl esteN'-Cyclopentylidene-hydrazinecarboxylic acid tert-butyl esterN''-CYCLOPENTYLIDENE-HYDRAZINECARBOXYLIC ACID TERT-BUTYL ESTER2-cyclopentylideneHydrazinecarboxylic acid 1,1-dimethylethyl ester

JIWAYUZEWSSBRC-UHFFFAOYSA-NHMS1784N171-Boc-2-cyclopentylidene-hydrazineEDA20139AB6630AKOS006241109DA-26322EN300-66232

データベース識別子

CAS: 79201-39-1
PubChem CID: 4058837
DTXSID: DTXSID60398874
EC Number: 898-733-1

物性

構造計算による物性

XLogP: 1.6
極性表面積: 50.7 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 3
重原子数: 14
形式電荷: 0
複雑度: 233

物理化学的性質

融点: 123 · 123-124 °C
比重(密度): 1.09 · 1.09±0.1 g/cm3(Predicted)
酸解離定数(Pka): 10.97 · 10.97±0.20(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

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, P317, 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)

安全データ

hs_code: 2928009090

化学と産業

サプライヤー9 社

苏州施亚生物科技有限公司17715136450 · [email protected]

Protheragen-ING+86-15618352007 · [email protected]

天津诺康医药科技有限公司022-23989838 13810451150 · [email protected]

苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]

上海洪创医药科技有限公司18151128828 · [email protected]

化合物ノート

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