(1S,2S)-(-)-1,2-ジフェニルエチレンジアミン

(1S,2S)-1,2-diphenylethane-1,2-diamine

HCID 6931238CAS 16635-95-3

部分構造検索類似構造を探す

基本情報

標準SMILES: N[C@@H](c1ccccc1)[C@@H](N)c1ccccc1
InChIKey: PONXTPCRRASWKW-KBPBESRZSA-N
分子式: C14H16N2
平均分子量: 212.29 g/mol
単同位体質量: 212.13134852

名称と識別子

優先名称: (1S,2S)-1,2-diphenylethane-1,2-diamine
IUPAC: (1S,2S)-1,2-diphenylethane-1,2-diamine
現地名: (±)-1,2-ジフェニルエチレンジアミン
英語名: 1,2-Diphenylethylenediamine
分子式: C14H16N2
分子量: 212.29

名称と別名

(1S,2S)-1,2-diphenylethane-1,2-diamineRefChem:393988608-420-129841-69-8(1S,2S)-(-)-1,2-Diphenylethylenediamine(1S,2S)-(-)-1,2-Diphenyl-1,2-ethanediamineMFCD00082751(1s,2s)-1,2-diphenyl-1,2-ethanediamine1,2-Ethanediamine, 1,2-diphenyl-, (1S,2S)-(-)-1,2-diphenylethylenediamine(1s,2s)-1,2-diphenylethylenediamine16635-95-3

名称をさらに表示

(±)-1,2-ジフェニルエチレンジアミン(±)-1,2-ジアミノ-1,2-ジフェニルエタンTRANS-STILBENE1,2-DIPHENYLETHYLENESTILBENE, TRANS-DL-1,2-Diphenyl-1,2-ethanediamineBibenzilBIBENZALTRANS-TOLUYLENETRANS-BIBENZYLIDENESTILBENE, trans-(RG)TRANS-1,2-DIPHENYLETHYLENE

(S,S)-DPEN(+/-)-Stilbenediamine(1S,2S)-(-)-1,2-Diamino-1,2-diphenylethane(-)-STILBENEDIAMINErac-1,2-Diphenylethane-1,2-diaminedl-StilbenediamineNSC-167211((1S,2S)-2-Amino-1,2-diphenylethyl)amine; (-)-Stilbenediamine; (S,S)-1,2-Diamino-1,2-diphenylethane; (S,S)-1,2-Diphenylethylene-1,2-diamine;

データベース識別子

CAS: 16635-95-3、29841-69-8
PubChem CID: 6931238
DTXSID: DTXSID20426127
ChEMBL: CHEMBL467308
UNII: 9BB7UW58PU、W52J5QHV92
EC Number: 605-438-1、608-420-1
Nikkaji: J276.439C

物性

構造計算による物性

XLogP: 1.4
極性表面積: 52 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 3
重原子数: 16
形式電荷: 0
複雑度: 171

物理化学的性質

融点: 123 · 123-125 °C(lit.)
沸点: 305 · 305-307 °C744 mm Hg(lit.)
比重(密度): 0.97 g/mL · 0.97 g/mL at 25 °C(lit.)
貯蔵温度: 2 · Keep in dark place,Inert atmosphere,2-8°C
溶解性: soluble in Methanol
外見: powder to crystal
酸解離定数(Pka): 9.78 · 9.78±0.10(Predicted)
色: White to Yellow to Orange
CAS データベース: 16635 · 16635-95-3(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 6 件

Warning

H315 (91.8%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (89.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (89.8%): 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 49 reports by companies from 9 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 Categories · 2 件

Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

Skin Irrit. 2 (91.8%)；Eye Irrit. 2 (89.8%)；STOT SE 3 (89.8%)

安全データ

wgk: 2
rtecs: WJ4926500
ridadr: 2735
hs_code: 2921.59.8090
risk_code: 22-36-51/53
hazard_code: Xn,N
safety_code: 26-36/37-61

化学と産業

応用分野 · 1 件

使用1,2-Diphenylethylenediamine (DPE) has been found to react in a neutral medium with catecholamines and other catechol compounds in the presence of hexacyanoferrate(III) to give a compound that fluoresces intensely. The reaction is accelerated by amino acids such as glycine. Nohta et al. described a sensitive spectrofluorimetric method for determining catecholamines with 1,2diphenylethylenediamine. The method is based on the reaction of catechol compounds in a neutral medium with 1,2-diphenylethylenediamine in the presence of hexacyanoferrate(II1) and glycine at ambient temperature. The fluorescence shows excitation and emission maxima around 345 and 480 nm, respectively. The method is simple, selective for catechol compounds, and very sensitive. Catecholamines can be determined at concentrations as low as 15-20 pmol ml-1[1].

上流・下流製品情報

下流製品

サプライヤー50 社

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

绍兴赜军生物医药科技有限公司0575-82126188 15395856318

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

成都丽凯手性技术有限公司028-85247892 · [email protected]