| CAS Number | 75224-28-1 |
| Catalog Number | AG01A5FE(AGN-PC-0WNOLD) |
| Chemical Name | 4-Chloro-5-nitroquinazoline |
| IUPAC Name | 4-chloro-5-nitroquinazoline |
| InChI | InChI=1S/C8H4ClN3O2/c9-8-7-5(10-4-11-8)2-1-3-6(7)12(13)14/h1-4H |
| InChI Key | DLSCGOLGMJZMMZ-UHFFFAOYSA-N |
| MDL Number | MFCD18448299 |
| Molecular Formula | C8H4ClN3O2 |
| Molecular Weight | 209.5893 |
| SMILES | [O-][N+](C1=C2C(N=CN=C2Cl)=CC=C1)=O |
| Synonyms | 4-chloro-5-nitroquinazoline,
75224-28-1,
4-chloro-5-nitro-quinazoline,
SCHEMBL11246685,
4-Chloro-5-nitroquinazoline, 9CI,
ZINC95347691,
AKOS026727803,
NE41964,
SY035694,
MFCD18448299 (95%),
Z1982491246,
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| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.589g/mol |
| Monoisotopic Mass | 208.999g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 71.6A^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