| CAS Number | 1265236-34-7 |
| Catalog Number | AG000SV1(AGN-PC-0HP0C9) |
| Chemical Name | 1-Chloro-2-(cyclopropylmethoxy)-4-nitrobenzene |
| IUPAC Name | 1-chloro-2-(cyclopropylmethoxy)-4-nitrobenzene |
| InChI | InChI=1S/C10H10ClNO3/c11-9-4-3-8(12(13)14)5-10(9)15-6-7-1-2-7/h3-5,7H,1-2,6H2 |
| InChI Key | QMJYEEVSIREZCG-UHFFFAOYSA-N |
| MDL Number | MFCD21333108 |
| Molecular Formula | C10H10ClNO3 |
| Molecular Weight | 227.6443 |
| SMILES | Clc1ccc(cc1OCC1CC1)[N+](=O)[O-] |
| Synonyms | 1-Chloro-2-(cyclopropylmethoxy)-4-nitrobenzene,
1265236-34-7,
ACMC-209bbd,
SCHEMBL10002964,
CTK8A9926,
DTXSID00737884,
QMJYEEVSIREZCG-UHFFFAOYSA-N,
ANW-18935,
MFCD21333108,
ZINC85476767,
AKOS018445245,
TC-107680,
FT-0745242,
Z9328,
1-chloro-2-cyclopropylmethoxy-4-nitro-benzene,
B-8869,
Benzene, 1-chloro-2-(cyclopropylmethoxy)-4-nitro-,
C10H10ClNO3,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.644g/mol |
| Monoisotopic Mass | 227.035g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number