| CAS Number | 1125-62-8 |
| Catalog Number | AG003A4T(AGN-PC-0NJHUM) |
| Chemical Name | 4-chloro-5,6,7,8-tetrahydroquinazoline |
| IUPAC Name | 4-chloro-5,6,7,8-tetrahydroquinazoline |
| InChI | InChI=1S/C8H9ClN2/c9-8-6-3-1-2-4-7(6)10-5-11-8/h5H,1-4H2 |
| InChI Key | AHCZEYDUHAFFKD-UHFFFAOYSA-N |
| MDL Number | MFCD12755923 |
| Molecular Formula | C8H9ClN2 |
| Molecular Weight | 168.6235 |
| SMILES | ClC1=NC=NC=2CCCCC12 |
| Synonyms | 4-Chloro-5,6,7,8-tetrahydroquinazoline,
1125-62-8,
SCHEMBL855087,
DTXSID40503348,
AHCZEYDUHAFFKD-UHFFFAOYSA-N,
ZINC39250025,
AKOS010640705,
AB65892,
NE45004,
AJ-99389,
SC-90591,
F1905-0051,
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| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.624g/mol |
| Monoisotopic Mass | 168.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number