| CAS Number | 207277-11-0 |
| Catalog Number | AG00CFRJ(AGN-PC-0WOHCF) |
| Chemical Name | 5-Methyl-3-thiophenemethanol
|
| IUPAC Name | (5-methylthiophen-3-yl)methanol |
| InChI | InChI=1S/C6H8OS/c1-5-2-6(3-7)4-8-5/h2,4,7H,3H2,1H3 |
| InChI Key | TZUNKFFVTXJZRN-UHFFFAOYSA-N |
| MDL Number | MFCD08457406 |
| Molecular Formula | C6H8OS |
| Molecular Weight | 128.1921 |
| SMILES | C(O)c1cc(C)sc1 |
| Synonyms | 5-methyl-3-thiophenemethanol,
(5-methylthiophen-3-yl)methanol,
207277-11-0,
(5-methyl-3-thienyl)methan-1-ol,
(5-methyl-3-thienyl)methanol,
SCHEMBL2735670,
3-Thiophenemethanol, 5-methyl-,
TZUNKFFVTXJZRN-UHFFFAOYSA-N,
ZINC6857783,
SBB017457,
AKOS001921285,
MCULE-8945003844,
ST078451,
FT-0726358,
(5-Methylthiophen-3-yl)methanol, AldrichCPR,
|
| Complexity | 74.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.189g/mol |
| Monoisotopic Mass | 128.03g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number