Cas no 784143-97-1 (Pyrano[4,3-b]indole,1,3,4,5-tetrahydro-)
784143-97-1 structure
Product Name:Pyrano[4,3-b]indole,1,3,4,5-tetrahydro-
CAS No:784143-97-1
MF:C11H11NO
MW:173.211142778397
CID:554284
PubChem ID:33697207
Update Time:2025-04-19
Pyrano[4,3-b]indole,1,3,4,5-tetrahydro- Chemical and Physical Properties
Names and Identifiers
-
- Pyrano[4,3-b]indole,1,3,4,5-tetrahydro-
- 1,3,4,5-tetrahydropyrano[4,3-b]indole
- 1,3,4,5-TETRAHYDRO-PYRANO[4,3-B]INDOLE
- 1H,3H,4H,5H-PYRANO[4,3-B]INDOLE
- AB26254
- AG-H-14674
- CTK5E5762
- AKOS006294116
- 784143-97-1
- DTXSID80652824
-
- Inchi: 1S/C11H11NO/c1-2-4-10-8(3-1)9-7-13-6-5-11(9)12-10/h1-4,12H,5-7H2
- InChI Key: BUQKZKMCGKVWEV-UHFFFAOYSA-N
- SMILES: O1CCC2=C(C1)C1C=CC=CC=1N2
Computed Properties
- Exact Mass: 173.08400
- Monoisotopic Mass: 173.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 195
- 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: 1.8
- Topological Polar Surface Area: 25?2
Experimental Properties
- PSA: 25.02000
- LogP: 2.24060
Pyrano[4,3-b]indole,1,3,4,5-tetrahydro- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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