| CAS Number | 875238-39-4 |
| Catalog Number | AG019XMM(AGN-PC-0WO93S) |
| Chemical Name | (2,5-Dimethylthiophen-3-yl)methanol |
| IUPAC Name | (2,5-dimethylthiophen-3-yl)methanol |
| InChI | InChI=1S/C7H10OS/c1-5-3-7(4-8)6(2)9-5/h3,8H,4H2,1-2H3 |
| InChI Key | CVQUIXMHNWJFGY-UHFFFAOYSA-N |
| MDL Number | MFCD11208334 |
| Molecular Formula | C7H10OS |
| Molecular Weight | 142.2187 |
| SMILES | CC1SC(C)=C(CO)C=1 |
| Synonyms | (2,5-dimethylthiophen-3-yl)methanol,
875238-39-4,
EN300-55412,
Z839522524,
(2,5-Dimethyl-thiophen-3-yl)-methanol,
AC1Q2IOL,
SCHEMBL8545497,
CTK8A2696,
ZINC36929888,
2,5-dimethyl-3-hydroxymethylthiophene,
AKOS009333710,
MCULE-3470465755,
NE31548,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.216g/mol |
| Monoisotopic Mass | 142.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number