| CAS Number | 1260383-49-0 |
| Catalog Number | AG00HISL(AGN-PC-0WOFSQ) |
| Chemical Name | methyl4-bromo-2-methyl-1H-indole-6-carboxylate |
| IUPAC Name | methyl 4-bromo-2-methyl-1H-indole-6-carboxylate |
| InChI | InChI=1S/C11H10BrNO2/c1-6-3-8-9(12)4-7(11(14)15-2)5-10(8)13-6/h3-5,13H,1-2H3 |
| InChI Key | WWISWWDVNPDLJC-UHFFFAOYSA-N |
| MDL Number | MFCD18380825 |
| Molecular Formula | C11H10BrNO2 |
| Molecular Weight | 268.1066 |
| SMILES | CC1=CC2=C(C=C(C=C2N1)C(=O)OC)Br |
| Synonyms | 1260383-49-0,
Methyl 4-bromo-2-methyl-1H-indole-6-carboxylate,
4-Bromo-2-methyl-1H-indole-6-carboxylic acid methyl ester,
methyl4-bromo-2-methyl-1H-indole-6-carboxylate,
KS-00000TGJ,
MFCD18380825,
ZINC96320683,
AKOS027254395,
SB14742,
AK204779,
DS-10375,
FT-0715956,
W-1950,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.989g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.11g/mol |
| Monoisotopic Mass | 266.989g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number