| CAS Number | 34887-78-0 |
| Catalog Number | AG01A0XG(AGN-PC-0WOI2X) |
| Chemical Name | 1-Chloro-3-(1-chloroethyl)benzene |
| IUPAC Name | 1-chloro-3-(1-chloroethyl)benzene |
| InChI | InChI=1S/C8H8Cl2/c1-6(9)7-3-2-4-8(10)5-7/h2-6H,1H3 |
| InChI Key | UEDWCYBNUKGVRI-UHFFFAOYSA-N |
| MDL Number | MFCD10692296 |
| Molecular Formula | C8H8Cl2 |
| Molecular Weight | 175.0551 |
| SMILES | CC(C1=CC(Cl)=CC=C1)Cl |
| Synonyms | 1-chloro-3-(1-chloroethyl)benzene,
34887-78-0,
1-Chloro-3-(1-chloro-ethyl)-benzene,
SCHEMBL8094299,
NE25181,
AM100696,
F1901-0272,
CID9855605,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.052g/mol |
| Monoisotopic Mass | 174g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number