| CAS Number | 917460-32-3 |
| Catalog Number | AG00IVVM(AGN-PC-0WB2R6) |
| Chemical Name | 2-(2-amino-2,3-dihydro-1H-inden-2-yl)acetic acid |
| IUPAC Name | 2-(2-amino-1,3-dihydroinden-2-yl)acetic acid |
| InChI | InChI=1S/C11H13NO2/c12-11(7-10(13)14)5-8-3-1-2-4-9(8)6-11/h1-4H,5-7,12H2,(H,13,14) |
| InChI Key | BUBBNTKAGQQNKW-UHFFFAOYSA-N |
| MDL Number | MFCD20384999 |
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.2264 |
| SMILES | O=C(O)CC1(N)(CC2(=CC=CC=C2(C1))) |
| Synonyms | 2-(2-amino-2,3-dihydro-1H-inden-2-yl)acetic acid,
917460-32-3,
2-amino-2,3-dihydro-1H-Indene-2-acetic acid,
SCHEMBL4240413,
KS-00002BDA,
ZINC82762651,
AKOS013991052,
MCULE-1147751055,
SS-4781,
SC-65849,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.23g/mol |
| Monoisotopic Mass | 191.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number