Cas no 108701-34-4 (1,1,2,3,3,5-hexamethyl-6-nitro-2h-indene)
108701-34-4 structure
Product Name:1,1,2,3,3,5-hexamethyl-6-nitro-2h-indene
CAS No:108701-34-4
MF:C15H21NO2
MW:247.33274435997
CID:1186311
PubChem ID:19810368
Update Time:2025-04-20
1,1,2,3,3,5-hexamethyl-6-nitro-2h-indene Chemical and Physical Properties
Names and Identifiers
-
- 1,1,2,3,3,5-hexamethyl-6-nitro-2h-indene
- 1,1,2,3,3,5-Hexamethyl-6-nitro-2,3-dihydro-1H-indene
- DTXSID80600204
- 108701-34-4
- LPLMIFZYWGZTRL-UHFFFAOYSA-N
- 1,1,2,3,3,6-HEXAMETHYL-5-NITRO INDANE
- SCHEMBL9418414
-
- Inchi： 1S/C15H21NO2/c1-9-7-11-12(8-13(9)16(17)18)15(5,6)10(2)14(11,3)4/h7-8,10H,1-6H3
- InChI Key： LPLMIFZYWGZTRL-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C(C)=CC2=C(C=1)C(C)(C)C(C)C2(C)C)=O
Computed Properties
- Exact Mass: 247.15733
- Monoisotopic Mass: 247.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 356
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
1,1,2,3,3,5-hexamethyl-6-nitro-2h-indene Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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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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