| CAS Number | 466686-79-3 |
| Catalog Number | AG00E6P6(AGN-PC-07AUKV) |
| Chemical Name | 4-Chlorothiazole-2-carbaldehyde |
| IUPAC Name | 4-chloro-1,3-thiazole-2-carbaldehyde |
| InChI | InChI=1S/C4H2ClNOS/c5-3-2-8-4(1-7)6-3/h1-2H |
| InChI Key | FIRXGZJYHGJBPL-UHFFFAOYSA-N |
| MDL Number | MFCD18817008 |
| Molecular Formula | C4H2ClNOS |
| Molecular Weight | 147.5828 |
| SMILES | ClC1N=C(C=O)SC=1 |
| Synonyms | 4-chloro-1,3-thiazole-2-carbaldehyde,
466686-79-3,
4-chlorothiazole-2-carbaldehyde,
2-Thiazolecarboxaldehyde, 4-chloro-,
SCHEMBL15794864,
FIRXGZJYHGJBPL-UHFFFAOYSA-N,
MFCD18817008,
ZINC39134652,
2-Thiazolecarboxaldehyde, 4-chloro-,
AKOS023410582,
NE18544,
SB18561,
AS-51352,
CS-0056853,
chlorothiazolecarbaldehyde,
2-Thiazolecarboxaldehyde,4-chloro-,
|
| Complexity | 100 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.576g/mol |
| Monoisotopic Mass | 146.955g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number