| CAS Number | 1352318-36-5 |
| Catalog Number | AG009WMA |
| Chemical Name | 4-Chloro-2-methoxy-1-(4-nitrophenyl)benzene |
| IUPAC Name | 4-chloro-2-methoxy-1-(4-nitrophenyl)benzene |
| InChI | InChI=1S/C13H10ClNO3/c1-18-13-8-10(14)4-7-12(13)9-2-5-11(6-3-9)15(16)17/h2-8H,1H3 |
| InChI Key | RHTBCGJBXRFXBI-UHFFFAOYSA-N |
| MDL Number | MFCD20529489 |
| Molecular Formula | C13H10ClNO3 |
| Molecular Weight | 263.6764 |
| SMILES | COc1cc(Cl)ccc1c1ccc(cc1)[N+](=O)[O-] |
| Synonyms | 4-Chloro-2-methoxy-1-(4-nitrophenyl)benzene,
1352318-36-5,
ACMC-209byy,
CTK8B0304,
DTXSID60718391,
ANW-19784,
MFCD20529489,
ZINC74937829,
AKOS026672792,
TC-108529,
Z9871,
4-Chloro-2-methoxy-4'-nitro-1,1'-biphenyl,
B-8510,
C13H10ClNO3,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.677g/mol |
| Monoisotopic Mass | 263.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number