Cas no 361436-24-0 (3-Isopropyl-1H-indol-5-ol)
3-Isopropyl-1H-indol-5-ol structure
Product Name:3-Isopropyl-1H-indol-5-ol
CAS No:361436-24-0
MF:C11H13NO
MW:175.227022886276
CID:921064
PubChem ID:22669491
Update Time:2024-02-29
3-Isopropyl-1H-indol-5-ol Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indol-5-ol,3-(1-methylethyl)-(9CI)
- 5-hydroxy-3-isopropylindole
- 3-isopropyl-1H-indol-5-ol
- 5-hydroxy-3-isopropyl-indole
- AGUCHSMRRNZFRZ-UHFFFAOYSA-N
- 3-Isopropyl-1H-indol-5-ol
-
- Inchi： 1S/C11H13NO/c1-7(2)10-6-12-11-4-3-8(13)5-9(10)11/h3-7,12-13H,1-2H3
- InChI Key： AGUCHSMRRNZFRZ-UHFFFAOYSA-N
- SMILES： OC1C=CC2=C(C=1)C(=CN2)C(C)C
Computed Properties
- Exact Mass: 175.099714038g/mol
- Monoisotopic Mass: 175.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 181
- 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
- Topological Polar Surface Area: 36
3-Isopropyl-1H-indol-5-ol Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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