主记录
AC1LGYES
- CAS
- 60698-25-1
- PubChem CID
- 878839
- SMILES
- CC1=CC=C(C=C1)OC(=O)C2=CC=C(O2)Br
- 分子式
- C12H9BrO3
- 分子量
- 281.105
- 精确分子量
- 279.9735
- InChI
- InChI=1S/C12H9BrO3/c1-8-2-4-9(5-3-8)15-12(14)10-6-7-11(13)16-10/h2-7H,1H3
- InChIKey
- AFERWRQYCZNTSB-UHFFFAOYSA-N
- LogP
- 3.5697
- TPSA
- 39.44
名称与别名
- AC1LGYES
- 4-methylphenyl 5-bromo-2-furoate
- CBMicro_042716
- MLS000533757
- CHEMBL1304182
- HMS2283N05
- ZINC448506
- CID878839
- ZINC00448506
- AKOS003071582
- (4-methylphenyl) 5-bromofuran-2-carboxylate
- SMR000141195
- BIM-0042850.P001
- AH-262/08501053
- 60698-25-1