| CAS Number | 1188143-94-3 |
| Catalog Number | AG01A30M(AGN-PC-0WO2SM) |
| Chemical Name | 4,6-dichloro-2,3-dihydro-1H-inden-1-ol |
| IUPAC Name | 4,6-dichloro-2,3-dihydro-1H-inden-1-ol |
| InChI | InChI=1S/C9H8Cl2O/c10-5-3-7-6(8(11)4-5)1-2-9(7)12/h3-4,9,12H,1-2H2 |
| InChI Key | ZIMJJJUNFVBXJO-UHFFFAOYSA-N |
| MDL Number | MFCD11219510 |
| Molecular Formula | C9H8Cl2O |
| Molecular Weight | 203.0652 |
| SMILES | OC1C2=CC(=CC(Cl)=C2CC1)Cl |
| Synonyms | 4,6-dichloro-2,3-dihydro-1H-inden-1-ol,
1188143-94-3,
4,6-dichloroindan-1-ol,
SCHEMBL15532208,
ZIMJJJUNFVBXJO-UHFFFAOYSA-N,
AKOS010642071,
NE44678,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.062g/mol |
| Monoisotopic Mass | 201.995g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number