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线性分子式:
C6H5CH2CH(NCO)CO2CH3
化学文摘社编号:
分子量:
205.21
UNSPSC Code:
12352108
PubChem Substance ID:
MDL number:
Assay:
99%
assay
99%
optical activity
[α]20/D −80.0°, neat
refractive index
n20/D 1.513 (lit.)
bp
244 °C (lit.)
density
1.13 g/mL at 25 °C (lit.)
SMILES string
COC(=O)[C@H](Cc1ccccc1)N=C=O
InChI
1S/C11H11NO3/c1-15-11(14)10(12-8-13)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3/t10-/m0/s1
InChI key
JOTMMIYKEOOTNZ-JTQLQIEISA-N
Application
该化合物已被用于制备血管紧张素原的二肽类似物以及抑制嗜热菌蛋白酶的席夫碱衍生物
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
116.1 °F - closed cup
flash_point_c
46.7 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
此项目有
Bates, S.R.E. et al.
J. Chem. Res. Synop., 48-48 (1993)
J J Plattner et al.
Journal of medicinal chemistry, 31(12), 2277-2288 (1988-12-01)
A series of renin inhibitors have been prepared and evaluated for their susceptibility to cleavage by the serine protease chymotrypsin. The compounds were designed by consideration of the structural requirements in the active-site region of renin and chymotrypsin. By systematic


