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结构：Cc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)[C@@H](N)c2ccccc2)cc1
HCID6612782

(1S,2S)-(+)-N-p-Tosyl-1,2-diphenylethylenediamine

N-[(1S,2S)-2-amino-1,2-diphenylethyl]-4-methylbenzenesulfonamide

C21H22N2O2S366.5 g/molCAS 167316-27-0
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IDENTITY

结构与身份

标准 SMILES
Cc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)[C@@H](N)c2ccccc2)cc1
InChIKey
UOPFIWYXBIHPIP-SFTDATJTSA-N
分子式
C21H22N2O2S
平均分子量
366.5 g/mol
单同位素质量
366.14019912

COMPUTED

结构计算性质

已同步
XLogP
3.4
极性表面积
80.6 Ų
氢键供体
2
氢键受体
4
可旋转键
6
重原子
26
形式电荷
0
复杂度
511

GHS

GHS 分类

来源：PubChem
GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (54.8%): 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 84 reports by companies from 5 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.

HAZARDS

危害信息

来源：PubChem
Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (54.8%)

ALIASES

名称与别名

共 52 条
(1S,2S)-(+)-N-p-Tosyl-1,2-diphenylethylenediamineRefChem:393978626-353-6167316-27-0(S,S)-TSDPEN(1S,2S)-(+)-N-(4-Toluenesulfonyl)-1,2-diphenylethylenediamineN-[(1S,2S)-2-amino-1,2-diphenylethyl]-4-methylbenzenesulfonamideN-((1S,2S)-2-amino-1,2-diphenylethyl)-4-methylbenzenesulfonamideMFCD03095684Benzenesulfonamide, N-[(1S,2S)-2-amino-1,2-diphenylethyl]-4-methyl-C21H22N2O2SN-[(1S,2S)-2-amino-1,2-diphenyl-ethyl]-4-methyl-benzenesulfonamide(S,S)-N-(p-Toluenesulfonyl)-1,2-diphenylethylenediamine(1s,2s)-n-(p-toluenesulfonyl)-1,2-diphenylethanediamine(IS,2S)-TsDPENCBiol_000203(1S,2S)-TSDPENSCHEMBL130104orb2940239CHEMBL5306136

REACTIONS

参与反应

29 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂