| CAS Number | 1245568-73-3 |
| Catalog Number | AG00HHOP(AGN-PC-0WBKRV) |
| Chemical Name | 2-(4-Amino-1H-indol-1-yl)acetic acid |
| IUPAC Name | 2-(4-aminoindol-1-yl)acetic acid |
| InChI | InChI=1S/C10H10N2O2/c11-8-2-1-3-9-7(8)4-5-12(9)6-10(13)14/h1-5H,6,11H2,(H,13,14) |
| InChI Key | FBUKGBFOOAVIJN-UHFFFAOYSA-N |
| MDL Number | MFCD17430318 |
| Molecular Formula | C10H10N2O2 |
| Molecular Weight | 190.1986 |
| SMILES | NC1=C2C(N(C=C2)CC(O)=O)=CC=C1 |
| Synonyms | 2-(4-amino-1H-indol-1-yl)acetic acid,
(4-amino-1H-indol-1-yl)acetic acid,
1245568-73-3,
SCHEMBL3174313,
ALBB-028626,
BBL032762,
MFCD17430318,
STL146396,
ZINC49538515,
1H-indole-1-acetic acid, 4-amino-,
AKOS005721013,
MCULE-5487667572,
2-(4-aminoindol-1-yl)acetic acid,
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| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.202g/mol |
| Monoisotopic Mass | 190.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number