Cas no 95538-31-1 (1H-Indole-2-carbonylchloride, 5-methyl-)
95538-31-1 structure
Product Name:1H-Indole-2-carbonylchloride, 5-methyl-
CAS No:95538-31-1
MF:C10H8ClNO
MW:193.629621505737
CID:799553
PubChem ID:13466370
Update Time:2025-04-19
1H-Indole-2-carbonylchloride, 5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-2-carbonylchloride, 5-methyl-
- 1H-INDOLE-2-CARBONYL CHLORIDE,5-METHYL--
- 1H-Indole-2-carbonylchloride,5-methyl-(9CI)
- 5-methyl-1H-indole-2-carbonyl chloride
- 95538-31-1
- SCHEMBL3535493
- DTXSID70541551
- 5-methyl-1h-indole-2-carbonylchloride
- AKOS006318437
-
- Inchi： 1S/C10H8ClNO/c1-6-2-3-8-7(4-6)5-9(12-8)10(11)13/h2-5,12H,1H3
- InChI Key： RIHSEHIILZGQRQ-UHFFFAOYSA-N
- SMILES： ClC(C1=CC2C=C(C)C=CC=2N1)=O
Computed Properties
- Exact Mass: 193.0294416g/mol
- Monoisotopic Mass: 193.0294416g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 219
- 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: 3.3
- Topological Polar Surface Area: 32.9?2
1H-Indole-2-carbonylchloride, 5-methyl- Related Literature
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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