| CAS Number | 147871-74-7 |
| Catalog Number | AG00AQK2(AGN-PC-0LTFCU) |
| Chemical Name | 2-Methyl-3-propylthiophene |
| IUPAC Name | 2-methyl-3-propylthiophene |
| InChI | InChI=1S/C8H12S/c1-3-4-8-5-6-9-7(8)2/h5-6H,3-4H2,1-2H3 |
| InChI Key | WACBPVASTREVAF-UHFFFAOYSA-N |
| MDL Number | MFCD22574947 |
| Molecular Formula | C8H12S |
| Molecular Weight | 140.2459 |
| SMILES | CCCc1ccsc1C |
| Synonyms | 2-methyl-3-propylthiophene,
147871-74-7,
Thiophene, 2-methyl-3-propyl,
AC1O59BF,
SCHEMBL1521714,
Thiophene, 2-methyl-3-propyl-,
WACBPVASTREVAF-UHFFFAOYSA-N,
KM3874,
ZINC33952120,
CJ-18128,
V3396,
C8H12S,
CID6429953,
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| Complexity | 80.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.244g/mol |
| Monoisotopic Mass | 140.066g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number