Cas no 887588-77-4 (7-Nitro-1H-indazole-3-carbaldehyde)
887588-77-4 structure
Product Name:7-Nitro-1H-indazole-3-carbaldehyde
CAS No:887588-77-4
MF:C8H5N3O3
MW:191.143601179123
CID:1083783
PubChem ID:22055529
Update Time:2025-04-20
7-Nitro-1H-indazole-3-carbaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 7-Nitro-1H-indazole-3-carbaldehyde
- 887588-77-4
- SCHEMBL3534877
- AKOS006230341
- DB-369583
-
- Inchi： 1S/C8H5N3O3/c12-4-6-5-2-1-3-7(11(13)14)8(5)10-9-6/h1-4H,(H,9,10)
- InChI Key： CNBVSGUQWCNKAM-UHFFFAOYSA-N
- SMILES： O=CC1=C2C=CC=C(C2=NN1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 191.03309103g/mol
- Monoisotopic Mass: 191.03309103g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 253
- 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: 1.2
- Topological Polar Surface Area: 91.6?2
7-Nitro-1H-indazole-3-carbaldehyde Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
887588-77-4 (7-Nitro-1H-indazole-3-carbaldehyde) Related Products
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