Cas no 478840-21-0 (1H-Indazol-5-ol,4-(1-methylethyl)-(9CI))
478840-21-0 structure
Product Name:1H-Indazol-5-ol,4-(1-methylethyl)-(9CI)
CAS No:478840-21-0
MF:C10H12N2O
MW:176.215082168579
CID:931535
PubChem ID:22933604
Update Time:2025-04-19
1H-Indazol-5-ol,4-(1-methylethyl)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazol-5-ol,4-(1-methylethyl)-(9CI)
- 4-propan-2-yl-1H-indazol-5-ol
- 4-isopropyl-1H-indazol-5-ol
- SCHEMBL5401834
- 4-(PROPAN-2-YL)-1H-INDAZOL-5-OL
- 478840-21-0
- DB-412784
- HYSZUZGRINTERZ-UHFFFAOYSA-N
- MB69276
-
- Inchi： 1S/C10H12N2O/c1-6(2)10-7-5-11-12-8(7)3-4-9(10)13/h3-6,13H,1-2H3,(H,11,12)
- InChI Key： HYSZUZGRINTERZ-UHFFFAOYSA-N
- SMILES： OC1C=CC2=C(C=NN2)C=1C(C)C
Computed Properties
- Exact Mass: 176.094963011g/mol
- Monoisotopic Mass: 176.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 184
- 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: 2.3
- Topological Polar Surface Area: 48.9?2
1H-Indazol-5-ol,4-(1-methylethyl)-(9CI) Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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