| CAS Number | 167479-21-2 |
| Catalog Number | AG01A4X1(AGN-PC-0NB4SK) |
| Chemical Name | Methyl 1-methyl-1H-indole-7-carboxylate |
| IUPAC Name | methyl 1-methylindole-7-carboxylate |
| InChI | InChI=1S/C11H11NO2/c1-12-7-6-8-4-3-5-9(10(8)12)11(13)14-2/h3-7H,1-2H3 |
| InChI Key | LNDHWKPWDYJATD-UHFFFAOYSA-N |
| MDL Number | MFCD12025398 |
| Molecular Formula | C11H11NO2 |
| Molecular Weight | 189.2105 |
| SMILES | O=C(C1=CC=CC2=C1N(C)C=C2)OC |
| Synonyms | methyl 1-methyl-1H-indole-7-carboxylate,
167479-21-2,
Methyl 1-Methyl-7-indolecarboxylate,
Methyl 1-methylindole-7-carboxylate,
KSC941Q6L,
SCHEMBL1093499,
CTK8E1865,
LNDHWKPWDYJATD-UHFFFAOYSA-N,
6903AJ,
ZINC34500648,
AKOS027256897,
RTR-007003,
SY022490,
FT-0745887,
MFCD12025398 (95%),
1,4-BUTANE SULTONE,
C11H11NO2,
CID10821478,
1-methyl-1H-indole-7-carboxylic acid methyl ester,
1633-83-6,
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| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.214g/mol |
| Monoisotopic Mass | 189.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number