1,3-ジベンジル尿素

Urea, N,N'-bis(phenylmethyl)-

HCID 72889CAS 1466-67-7

基本情報

標準SMILES: O=C(NCc1ccccc1)NCc1ccccc1
InChIKey: KATOLVAXCGIBLO-UHFFFAOYSA-N
分子式: C15H16N2O
平均分子量: 240.3 g/mol
単同位体質量: 240.12626313

概要

Urea, N,N'-bis(phenylmethyl)- has been reported in Pentadiplandra brazzeana, Moringa oleifera, and Salvadora oleoides with data available.

名称と識別子

優先名称: Urea, N,N'-bis(phenylmethyl)-
IUPAC: 1,3-dibenzylurea
現地名: 1,3-ジベンジル尿素
英語名: 1,3-dibenzylurea
分子式: C15H16N2O
分子量: 240.3

名称と別名

1,3-Dibenzylurea1466-67-7N,N'-DibenzylureaUrea, N,N'-bis(phenylmethyl)-sym-DibenzylureaZV725XJ34VEINECS 215-984-9NSC 408007NSC-408007AI3-19855DTXSID3061710N,N'-BIS(PHENYLMETHYL)UREA

名称をさらに表示

1,3-ジベンジル尿素N,N'-ジベンジル尿素N,N′-ジベンジル尿素1,3-bis(benzyl)urea1,3-bis(phenylmethyl)urea1,3-Dibenzylurea - [D94385]Lacosamide Impurity: 1,3-dibenzylureaLacosamide Impurity C 1,3-Dibenzyl-urea

RefChem:901281DTXCID0034770215-984-9InChI=1/C15H16N2O/c18-15(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,16,17,181,3-Dibenzyl-urea1,3-dibenzyl ureadibenzylureaUrea,N,N'-bis(phenylmethyl)-

データベース識別子

CAS: 1466-67-7
PubChem CID: 72889
DTXSID: DTXSID3061710
ChEMBL: CHEMBL504463
UNII: ZV725XJ34V
EC Number: 215-984-9
Nikkaji: J80.122D

物性

構造計算による物性

XLogP: 2.4
極性表面積: 41.1 Å²
水素結合供与体数: 2
水素結合受容体数: 1
回転可能結合数: 4
重原子数: 18
形式電荷: 0
複雑度: 219

物理化学的性質

貯蔵温度: Sealed in dry,Room Temperature
溶解性: DMSO (Slightly), Methanol (Slightly)
外見: Solid
色: White to Off-White
EPAの化学物質情報: Urea, N,N'-bis(phenylmethyl)- (1466-67-7)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

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

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, 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 CategoriesAcute Tox. 4 (100%)

安全データ

tsca: TSCA listed

化学と産業

用途と製造

General Manufacturing InformationUrea, N,N'-bis(phenylmethyl)-: INACTIVE

上流・下流製品情報

下流製品

N,N′-ジベンジルオキサミド

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