Cas no 6939-17-9 (3-propan-2-yloxadiazol-3-ium-5-olate)
6939-17-9 structure
Product Name:3-propan-2-yloxadiazol-3-ium-5-olate
CAS No:6939-17-9
MF:C5H8N2O2
MW:128.129220962524
CID:1735951
PubChem ID:201824
Update Time:2025-04-21
3-propan-2-yloxadiazol-3-ium-5-olate Chemical and Physical Properties
Names and Identifiers
-
- 3-propan-2-yloxadiazol-3-ium-5-olate
- NSC56786
- Sydnone, 3-isopropyl-
- Sydnone, 3-(1-methylethyl)-
- 3-isopropyl-sydnone
- 3-Isopropylsydnone
- AI3-61269
- BRN 4135220
- AC1L479D
- Sydnone,3-isopropyl
- NSC-56786
- 3-Isopropyl-1,2,3-oxadiazol-3-ium-5-olate
- NSC 56786
- 6939-17-9
- DTXSID30219502
-
- Inchi： 1S/C5H8N2O2/c1-4(2)7-3-5(8)9-6-7/h3-4H,1-2H3
- InChI Key： MOPOHBGHMCTYJK-UHFFFAOYSA-N
- SMILES： O1C(=C[N+](C(C)C)=N1)[O-]
Computed Properties
- Exact Mass: 128.05900
- Monoisotopic Mass: 128.058577502g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 97
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 53?2
Experimental Properties
- PSA: 52.97000
- LogP: 0.68680
3-propan-2-yloxadiazol-3-ium-5-olate Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
3-propan-2-yloxadiazol-3-ium-5-olate Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
-
5. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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