| CAS Number | 944893-74-7 |
| Catalog Number | AG006ABD(AGN-PC-0W43GO) |
| Chemical Name | 1-Ethyl-1H-indole-5-carbaldehyde |
| IUPAC Name | 1-ethylindole-5-carbaldehyde |
| InChI | InChI=1S/C11H11NO/c1-2-12-6-5-10-7-9(8-13)3-4-11(10)12/h3-8H,2H2,1H3 |
| InChI Key | WWOYPVXWHICMOY-UHFFFAOYSA-N |
| MDL Number | MFCD09455244 |
| Molecular Formula | C11H11NO |
| Molecular Weight | 173.2111 |
| SMILES | O=CC1=CC2=C(N(CC)C=C2)C=C1 |
| Synonyms | 1-ethyl-1H-indole-5-carbaldehyde,
944893-74-7,
1H-Indole-5-carboxaldehyde, 1-ethyl-,
1-ethylindole-5-carbaldehyde,
SCHEMBL9287208,
CTK5H6703,
DTXSID80589404,
ALBB-004946,
3942AF,
MFCD09455244,
STK501444,
ZINC15424294,
AKOS000321668,
MCULE-9794392743,
AJ-67316,
FT-0679048,
Y-5287,
I10-1160,
C11H11NO,
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| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.215g/mol |
| Monoisotopic Mass | 173.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number