| CAS Number | 4501-38-6 |
| Catalog Number | AG00393E(AGN-PC-0NIX7S) |
| Chemical Name | 1-Cyclohexyl-3-ethyl-benzene |
| IUPAC Name | 1-cyclohexyl-3-ethylbenzene |
| InChI | InChI=1S/C14H20/c1-2-12-7-6-10-14(11-12)13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9H2,1H3 |
| InChI Key | GAHPZHSJXHZZMG-UHFFFAOYSA-N |
| MDL Number | MFCD29090725 |
| Molecular Formula | C14H20 |
| Molecular Weight | 188.3086 |
| SMILES | C1(CCCCC1)C1=CC(=CC=C1)CC |
| Synonyms | 1-cyclohexyl-3-ethylbenzene,
4501-38-6,
1-cyclohexyl-3-ethyl-benzene,
m-ethylcyclohexylbenzene,
1-Ethyl-3-cyclohexylbenzene,
Benzene, 1-cyclohexyl-3-ethyl-,
MFCD29090725,
AKOS028112133,
KS-000002E4,
CS-0069848,
Benzene,1-cyclohexyl-3-ethyl-,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.157g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.314g/mol |
| Monoisotopic Mass | 188.157g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.3 |
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Certificate of Analysis
Lot Number