主记录
AC1N32I0
- CAS
- 380633-61-4
- PubChem CID
- 4080790
- SMILES
- CC1=NN(C(=C1[N+](=O)[O-])NP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC=CC=C4
- 分子式
- C22H19N4O5P
- 分子量
- 450.391
- 精确分子量
- 450.1093
- InChI
- InChI=1S/C22H19N4O5P/c1-17-21(26(27)28)22(25(23-17)18-11-5-2-6-12-18)24-32(29,30-19-13-7-3-8-14-19)31-20-15-9-4-10-16-20/h2-16H,1H3,(H,24,29)
- InChIKey
- GXGOTNFPRCVSBV-UHFFFAOYSA-N
- LogP
- 5.7669
- TPSA
- 108.52
名称与别名
- AC1N32I0
- GXGOTNFPRCVSBV-UHFFFAOYSA-N
- ZINC8384853
- ZINC08384853
- CID4080790
- diphenyl 4-nitro-3-methyl-1-phenyl-1H-pyrazol-5-ylamidophosphate
- AE-406/41056862
- N-diphenoxyphosphoryl-5-methyl-4-nitro-2-phenylpyrazol-3-amine
- 380633-61-4