| CAS Number | 153203-59-9 |
| Catalog Number | AG003J9F(AGN-PC-02K3PZ) |
| Chemical Name | 3-Chloro-5-formylbenzoic acid |
| IUPAC Name | 3-chloro-5-formylbenzoic acid |
| InChI | InChI=1S/C8H5ClO3/c9-7-2-5(4-10)1-6(3-7)8(11)12/h1-4H,(H,11,12) |
| InChI Key | LWVHCYUHVMWJLJ-UHFFFAOYSA-N |
| MDL Number | MFCD20658588 |
| Molecular Formula | C8H5ClO3 |
| Molecular Weight | 184.5765 |
| SMILES | O=C(O)C1=CC(C=O)=CC(Cl)=C1 |
| Synonyms | 3-CHLORO-5-FORMYLBENZOIC ACID,
153203-59-9,
3-formyl-5-chlorobenzoic acid,
SCHEMBL8979368,
LWVHCYUHVMWJLJ-UHFFFAOYSA-N,
5856AJ,
ZINC95764051,
AKOS024202721,
AB76525,
TRA0074827,
DA-09937,
SY026329,
FT-0711025,
Z-3659,
MFCD20658588 (97+%),
C8H5ClO3,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.993g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.575g/mol |
| Monoisotopic Mass | 183.993g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number