| CAS Number | 827595-34-6 |
| Catalog Number | AG004Z0H(AGN-PC-0WB4KF) |
| Chemical Name | 2-Chloro-5-ethoxy-4-methoxybenzaldehyde |
| IUPAC Name | 2-chloro-5-ethoxy-4-methoxybenzaldehyde |
| InChI | InChI=1S/C10H11ClO3/c1-3-14-10-4-7(6-12)8(11)5-9(10)13-2/h4-6H,3H2,1-2H3 |
| InChI Key | KNZCAGCZYDUJNP-UHFFFAOYSA-N |
| MDL Number | MFCD02629622 |
| Molecular Formula | C10H11ClO3 |
| Molecular Weight | 214.6455 |
| SMILES | C1(C=O)C=C(OCC)C(=CC=1Cl)OC |
| Synonyms | 2-chloro-5-ethoxy-4-methoxybenzaldehyde,
827595-34-6,
SCHEMBL1787396,
CTK5F0027,
DTXSID10598862,
AKOS B029002,
KNZCAGCZYDUJNP-UHFFFAOYSA-N,
ZINC2781892,
ZX-CM016781,
MFCD02629622,
SBB023493,
STK347845,
AKOS000103002,
MCULE-3114118195,
NCGC00338483-01,
AJ-44229,
ST45071461,
EN300-230520,
W-9548,
AB01331300-02,
AB01331300-03,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.645g/mol |
| Monoisotopic Mass | 214.04g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number