| CAS Number | 184151-47-1 |
| Catalog Number | AG00ABZ7(AGN-PC-03SRJL) |
| Chemical Name | 1-(6-Chloro-1H-indol-3-yl)ethanone |
| IUPAC Name | 1-(6-chloro-1H-indol-3-yl)ethanone |
| InChI | InChI=1S/C10H8ClNO/c1-6(13)9-5-12-10-4-7(11)2-3-8(9)10/h2-5,12H,1H3 |
| InChI Key | KQLYMFKKPNNGQR-UHFFFAOYSA-N |
| MDL Number | MFCD11212227 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | CC(C1C2=C(C=C(C=C2)Cl)NC=1)=O |
| Synonyms | 1-(6-chloro-1H-indol-3-yl)ethan-1-one,
184151-47-1,
1-(6-chloro-1h-indol-3-yl)ethanone,
Ethanone, 1-(6-chloro-1H-indol-3-yl)-,
AC1Q1JZR,
SCHEMBL3182218,
CTK6H1700,
MFCD11212227,
ZINC36379876,
AKOS009343111,
MCULE-3879923449,
NE43925,
1-(6-Chloro-1H-indol-3-yl)-ethanone,
SC-63721,
EN300-52414,
AB01004598-01,
1-(6-Chloro-1H-indol-3-yl)ethanone, AldrichCPR,
3-acetyl-6-chloro-1H-indole,
|
| Complexity | 219 |
| 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 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number