| CAS Number | 117752-77-9 |
| Catalog Number | AG01A3GK(AGN-PC-026CMV) |
| Chemical Name | 7-chloro-2-methyl-1H-indole-3-carbaldehyde |
| IUPAC Name | 7-chloro-2-methyl-1H-indole-3-carbaldehyde |
| InChI | InChI=1S/C10H8ClNO/c1-6-8(5-13)7-3-2-4-9(11)10(7)12-6/h2-5,12H,1H3 |
| InChI Key | RWGLFHTTZBZNMZ-UHFFFAOYSA-N |
| MDL Number | MFCD07440339 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | CC1=C(C=O)C2=C(C(=CC=C2)Cl)N1 |
| Synonyms | 7-chloro-2-methyl-1H-indole-3-carbaldehyde,
117752-77-9,
SCHEMBL6218865,
ZINC40165670,
AKOS002668321,
NE50596,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.63g/mol |
| Monoisotopic Mass | 193.029g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number