Basic information
- CAS
5973-29-5- Standard SMILES
CN1CC(=O)Nc2ccc(Cl)cc2C1=O- InChIKey
FNTLWYZULYTGHD-UHFFFAOYSA-N- Molecular formula
- C10H9ClN2O2
- Average molar mass
- 224.64 g/mol
- Monoisotopic mass
- 224.03525521
Names & identifiers
- Preferred name
- 1H-1,4-Benzodiazepine-2,5-dione, 7-chloro-3,4-dihydro-4-methyl-
- IUPAC
- 7-chloro-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
- English name
- 1H-1,4-Benzodiazepine-2,5-dione, 7-chloro-3,4-dihydro-4-methyl-
- Molecular formula
- C10H9ClN2O2
- Molecular weight
- 224.64
Names & synonyms
5973-29-5DTXSID004311931H-1,4-Benzodiazepine-2,5-dione, 7-chloro-3,4-dihydro-4-methyl-RefChem:237132DTXCID503820257-Chloro-4-methyl-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dioneFlumazenil Impurity 107-chloro-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione7-chloro-4-methyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dioneFlumazenil Impurity 9SCHEMBL2850811FNTLWYZULYTGHD-UHFFFAOYSA-N
Show more names
Nicarbazin Impurity 6
CS-01318827-Chloro-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Database identifiers
- CAS
5973-29-5- PubChem CID
- 9815949
- DTXSID
DTXSID00431193- Nikkaji
- J2.698.024K
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Melting point
- 233 · 233-235 °C
- Boiling point
- 469 · 469.0±45.0 °C(Predicted)
- Density
- 1.352 · 1.352±0.06 g/cm3(Predicted)
- pka
- 12.17 · 12.17±0.20(Predicted)
Chemistry & industry
Suppliers10 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
梯尔希（南京）药物研发有限公司18012923235 · [email protected]
南京熙泽医药科技有限公司025-66023220 15250997978 · [email protected]
长沙博诺新材料科技有限公司18191076804 · [email protected]
南京宁吉通医药生物科技有限公司0-19710401727 19710401727 · [email protected]
康迈迪森（北京）医药科技有限公司1851900025 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Related reactions
1 records
Compound notes
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