| CAS Number | 59394-27-3 |
| Catalog Number | AG00IAJS |
| Chemical Name | 7-Chloroquinoline-2-carbaldehyde |
| IUPAC Name | 7-chloroquinoline-2-carbaldehyde |
| InChI | InChI=1S/C10H6ClNO/c11-8-3-1-7-2-4-9(6-13)12-10(7)5-8/h1-6H |
| InChI Key | LZJIPAFEFGRTQS-UHFFFAOYSA-N |
| MDL Number | MFCD06407627 |
| Molecular Formula | C10H6ClNO |
| Molecular Weight | 191.6137 |
| SMILES | O=CC1=NC2=CC(Cl)=CC=C2C=C1 |
| Synonyms | 7-chloroquinoline-2-carbaldehyde,
59394-27-3,
7-Chloro-quinoline-2-carbaldehyde,
AC1LU7GG,
SCHEMBL3748357,
7-chloro-2-quinolinecarbaldehyde,
LZJIPAFEFGRTQS-UHFFFAOYSA-N,
7-Chloro-2-quinolinecarboxaldehyde,
ZINC1526706,
CC-882,
MFCD06407627,
2-Quinolinecarboxaldehyde, 7-chloro-,
AKOS006295332,
AM806098,
AS-39500,
SC-26220,
J3.495.358I,
ZINC01526706,
CID1548875,
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| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.614g/mol |
| Monoisotopic Mass | 191.014g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number