| CAS Number | 69975-67-3 |
| Catalog Number | AG00FASJ(AGN-PC-0WCBL5) |
| Chemical Name | 2,3-Dihydro-1H-indene-5-carbonitrile |
| IUPAC Name | 2,3-dihydro-1H-indene-5-carbonitrile |
| InChI | InChI=1S/C10H9N/c11-7-8-4-5-9-2-1-3-10(9)6-8/h4-6H,1-3H2 |
| InChI Key | LJOVFJHPHSEXLW-UHFFFAOYSA-N |
| MDL Number | MFCD09991848 |
| Molecular Formula | C10H9N |
| Molecular Weight | 143.1852 |
| SMILES | N#CC1=CC2=C(CCC2)C=C1 |
| Synonyms | Indane-5-carbonitrile,
69975-67-3,
2,3-DIHYDRO-1H-INDENE-5-CARBONITRILE,
Indan-5-carbonitrile,
SCHEMBL8222195,
KS-00003SZE,
DTXSID40574674,
SBB056393,
ZINC40448257,
AKOS012322577,
SC-42616,
SC-62135,
TS-01868,
X2081,
1H-INDENE-5-CARBONITRILE,2,3-DIHYDRO,
Z2130642146,
C10H9N,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.189g/mol |
| Monoisotopic Mass | 143.073g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number