| CAS Number | 54677-13-3 |
| Catalog Number | AG01C09S |
| Chemical Name | 1-Chloro-2,3,3-trimethylbutane |
| IUPAC Name | 1-chloro-2,3,3-trimethylbutane |
| InChI | InChI=1S/C7H15Cl/c1-6(5-8)7(2,3)4/h6H,5H2,1-4H3 |
| InChI Key | ZUIGQNGRMZCADY-UHFFFAOYSA-N |
| MDL Number | MFCD00961807 |
| Molecular Formula | C7H15Cl |
| Molecular Weight | 134.6470 |
| SMILES | CC(C(C)(C)C)CCl |
| Synonyms | 1-chloro-2,3,3-trimethylbutane,
54677-13-3,
AC1N60KO,
SCHEMBL20033678,
AKOS006381639,
1-chloro-2,3,3-trimethyl-butane,
CID4252425,
|
| Complexity | 61.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 134.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 134.647g/mol |
| Monoisotopic Mass | 134.086g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number