| CAS Number | 21078-65-9 |
| Catalog Number | AG002KYS(AGN-PC-0JSNUC) |
| Chemical Name | 2-Ethyl-1-decanol |
| IUPAC Name | 2-ethyldecan-1-ol |
| InChI | InChI=1S/C12H26O/c1-3-5-6-7-8-9-10-12(4-2)11-13/h12-13H,3-11H2,1-2H3 |
| InChI Key | LTHQZRHTXDZWGX-UHFFFAOYSA-N |
| MDL Number | MFCD21672161 |
| Molecular Formula | C12H26O |
| Molecular Weight | 186.3342 |
| SMILES | CCCCCCCCC(CC)CO |
| Synonyms | 2-Ethyl-1-decanol,
21078-65-9,
1-Decanol, 2-ethyl-,
2-ethyldecan-1-ol,
A1-01949,
2-ethyldecane-1-ol,
2-Ethyl-1-decanol #,
AC1LC09F,
SCHEMBL29904,
CTK0J8045,
DTXSID40337923,
LTHQZRHTXDZWGX-UHFFFAOYSA-N,
AKOS015402484,
TRA0012506,
1-Decanol,2-ethyl-,
CID545566,
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| Complexity | 91.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.198g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.339g/mol |
| Monoisotopic Mass | 186.198g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.8 |
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Certificate of Analysis
Lot Number