Benzal chloride
-
CAS Number 98-87-3
-
Catalog Number io-1783
-
Classification Aryl Halides
-
Molecular Weight 161.0300
-
SMILES C1=CC=C(C=C1)C(Cl)Cl
| Size | QTY | Notes | |
|---|---|---|---|
|
|
|
Add |
Benzal chloride is a member of benzenes.
| 1 | Benzal chloride |
| 2 | (DICHLOROMETHYL)BENZENE |
| 3 | Dichloromethylbenzene |
| 4 | alpha,alpha-Dichlorotoluene |
| 5 | Benzylidene chloride |
| Molecular Formula | C7H6Cl2 |
|---|---|
| Canonical SMILES | C1=CC=C(C=C1)C(Cl)Cl |
| Isomeric SMILES | C1=CC=C(C=C1)C(Cl)Cl |
| Molecular Weight | 161.0300 |
| InChIKey | CAHQGWAXKLQREW-UHFFFAOYSA-N |
| InChI | InChI=1S/C7H6Cl2/c8-7(9)6-4-2-1-3-5-6/h1-5,7H |
| XLogP | 3.0000 |
| ExactMass | 159.9847 |
| MonoisotopicMass | 159.9847 |
| TPSA | 0.0000 |
| Complexity | 75.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 0 |
| RotatableBondCount | 1 |
| HeavyAtomCount | 9 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 9815 |
| PatentFamilyCount | 4662 |
| LiteratureCount | 369 |
