| CAS Number | 36155-89-2 |
| Catalog Number | AG01A1FZ(AGN-PC-0WODIN) |
| Chemical Name | 4-Chlorothiophene-3-carbaldehyde |
| IUPAC Name | 4-chlorothiophene-3-carbaldehyde |
| InChI | InChI=1S/C5H3ClOS/c6-5-3-8-2-4(5)1-7/h1-3H |
| InChI Key | MXDGWCVDBWFTMC-UHFFFAOYSA-N |
| MDL Number | MFCD04971312 |
| Molecular Formula | C5H3ClOS |
| Molecular Weight | 146.5947 |
| SMILES | ClC=1C(=CSC1)C=O |
| Synonyms | 4-chlorothiophene-3-carbaldehyde,
36155-89-2,
AC1LGCQV,
SCHEMBL17215391,
MXDGWCVDBWFTMC-UHFFFAOYSA-N,
4-Chloro-3-thiophenecarboxaldehyde,
ZINC334485,
4-Chloro-thiophene-3-carboxaldehyde,
3-Thiophenecarboxaldehyde, 4-chloro-,
AKOS006295435,
AB85352,
NE60145,
CID819110,
|
| Complexity | 96.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.588g/mol |
| Monoisotopic Mass | 145.959g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number