4-(2-Meo-PH)-2,6-dimethyl-1,4-2H-pyridine-3,5-dicarboxylic acid diethyl ester

HCID 989165CAS 42972-42-9

基本情報

標準SMILES: CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccccc1OC
InChIKey: CKXAAXUYRZNYJP-UHFFFAOYSA-N
分子式: C20H25NO5
平均分子量: 359.4 g/mol

名称と識別子

優先名称: 4-(2-Meo-PH)-2,6-dimethyl-1,4-2H-pyridine-3,5-dicarboxylic acid diethyl ester
IUPAC: diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
英語名: diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
分子式: C20H25NO5
分子量: 359.42

名称と別名

42972-42-94-(2-MEO-PH)-2,6-DIMETHYL-1,4-2H-PYRIDINE-3,5-DICARBOXYLIC ACID DIETHYL ESTERRefChem:512558684-453-5diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylateREV-2686Oprea1_034110Oprea1_703557CHEMBL38777SCHEMBL3001176CKXAAXUYRZNYJP-UHFFFAOYSA-NSTK861965

名称をさらに表示

3,5-diethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-methoxyphenyl)-2,6-dimethyl-, 3,5-diethyl ester

AKOS000666692DA-19930CS-0298838AF-499/00045023Z903393013,5-dicarboethoxy-2,6-dimethyl-4-(2-methoxyphenyl)-1,4-dihydropyridinediethyl 1,4-dihydro-4-(2-methoxyphenyl)-2,6-dimethyl-3,5-pyridine dicarboxylatediethyl 4-(2-methoxyphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate

データベース識別子

CAS: 42972-42-9
PubChem CID: 989165
ChEMBL: CHEMBL38777
EC Number: 684-453-5
Nikkaji: J412.742K

物性

構造計算による物性

XLogP: 2.8
極性表面積: 73.9 Å²
水素結合供与体数: 1
水素結合受容体数: 6
回転可能結合数: 8
重原子数: 26
形式電荷: 0
複雑度: 567

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全データ

危険有害性情報: コード危険有害性情報危険有害性クラス区分注意喚起語シンボル P コード H315

化学と産業

サプライヤー4 社

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]

天津荣燊化工有限公司18317763565; 18317763565 · [email protected]

南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]