3-异噻唑丁酸(9CI)

CAS号
168985-28-2
CCD编号
CCD04471923
分子式
C9 H13 N O2
分子量
167.207

基本信息

产品名称: 3-异噻唑丁酸(9CI)
CAS: 168985-28-2
中文同义词: 3-异噻唑丁酸(9CI)
英文同义词: 1-[(1E)-BUT-1-EN-1-YL]-5-OXOPYRROLIDINE-2-CARBALDEHYDE ; 1-(1-BUTENYL)-5-OXO-2-PYRROLIDINECARBOXALDEHYDE ; 2-PYRROLIDINECARBOXALDEHYDE, 1-(1-BUTENYL)-5-OXO-
MDL号: MFCD18816714
氢键受体数量: 3
氢键供体数量: 0
Smile: CC/C=C/N1C(CCC1=O)C=O
InChi: InChI=1S/C9H13NO2/c1-2-3-6-10-8(7-11)4-5-9(10)12/h3,6-8H,2,4-5H2,1H3/b6-3+
InChiKey: InChIKey=XBZXCYXZINUSAX-ZZXKWVIFSA-N

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