| CAS Number | 951893-97-3 |
| Catalog Number | AG00NNRL(AGN-PC-0WCEWR) |
| Chemical Name | 3-(4-Chloro-2-methylphenyl)-1-propene |
| IUPAC Name | 4-chloro-2-methyl-1-prop-2-enylbenzene |
| InChI | InChI=1S/C10H11Cl/c1-3-4-9-5-6-10(11)7-8(9)2/h3,5-7H,1,4H2,2H3 |
| InChI Key | FPROMXIAKUTAJJ-UHFFFAOYSA-N |
| MDL Number | MFCD09801294 |
| Molecular Formula | C10H11Cl |
| Molecular Weight | 166.6473 |
| SMILES | ClC1=CC=C(CC=C)C(C)=C1 |
| Synonyms | 3-(4-CHLORO-2-METHYLPHENYL)-1-PROPENE,
951893-97-3,
4-chloro-2-methyl-1-(prop-2-en-1-yl)benzene,
CTK5J3967,
MFCD09801294,
ZINC71795204,
AKOS006327159,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.055g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.648g/mol |
| Monoisotopic Mass | 166.055g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number