3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE (CAS 91063-29-5) — formula C11H9ClN2OS, molecular weight 252.72; category organic chemicals.
| CAS Number | 91063-29-5 |
|---|---|
| Molecular Formula | C11H9ClN2OS |
| Molecular Weight | 252.72 |
| LogP | 2.5 |
| Category | Organic Chemicals |
3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE is a carbon-based organic compound with CAS registry number 91063-29-5 and molecular formula C11H9ClN2OS (molecular weight 252.72), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91063-29-5
Its molecular formula C11H9ClN2OS comprises 11 C, 9 H, 1 Cl, 2 N, 1 O, 1 S atoms.
Also known as: 3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE · 3-烯丙基-7-氯-2-巯基喹唑啉-4(3H)-酮
Category: organic chemicals
The CAS registry number of 3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE is 91063-29-5.
Molecular formula C11H9ClN2OS, molecular weight 252.72.
It is also registered under: 3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE, 3-烯丙基-7-氯-2-巯基喹唑啉-4(3H)-酮.
Category: Organic Chemicals.
Independent reference data for 3-ALLYL-7-CHLORO-2-MERCAPTO-3H-QUINAZOLIN-4-ONE (CAS 91063-29-5), compiled from public chemistry databases.
| CAS 号 | 91063-29-5 |
|---|---|
| PubChem CID | 2432667 |
| 分子式 | C11H9ClN2OS |
| IUPAC 名称 | 7-chloro-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one |
| Molecular Weight | 252.72 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 252.0124118 |
| Monoisotopic Mass | 252.0124118 |
| Topological Polar Surface Area | 64.4 |
| Heavy Atom Count | 16 |
91063-29-5; 3-Allyl-7-chloro-2-mercaptoquinazolin-4(3H)-one; 3-Allyl-7-chloro-2-mercapto-3H-quinazolin-4-one; 7-chloro-3-(prop-2-en-1-yl)-2-sulfanyl-3,4-dihydroquinazolin-4-one; 7-chloro-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one; DTXSID90368641; MFCD03988005; SBB078001; AKOS000117295; AKOS001053578; SY138240; CS-0459503; EN300-05700; G76209; 3-allyl-7-chloro-2-thioxo-1H-quinazolin-4-one; F779180
3-烯丙基-7-氯-2-巯基喹唑啉-4(3H)-酮 · CAS 91063-29-5 · C11H9ClN2OS.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.