(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate (CAS 425386-58-9) — formula C31H32N2O9, molecular weight 576.6; category organic chemicals.
| CAS Number | 425386-58-9 |
|---|---|
| Molecular Formula | C31H32N2O9 |
| Molecular Weight | 576.6 |
| Category | Organic Chemicals |
(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate is a carbon-based organic compound with CAS registry number 425386-58-9 and molecular formula C31H32N2O9 (molecular weight 576.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 425386-58-9
Its molecular formula C31H32N2O9 comprises 31 C, 32 H, 2 N, 9 O atoms.
Also known as: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate · (S)-1-氨基-3-甲基-4,5-二氢-1H-苯并[d]氮杂-2(3H)-酮(2R,3R)-2,3-双((4-甲基苯甲酰基)氧基)琥珀酸
Category: organic chemicals
The CAS registry number of (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate is 425386-58-9.
Molecular formula C31H32N2O9, molecular weight 576.6.
It is also registered under: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate, (S)-1-氨基-3-甲基-4,5-二氢-1H-苯并[d]氮杂-2(3H)-酮(2R,3R)-2,3-双((4-甲基苯甲酰基)氧基)琥珀酸.
Category: Organic Chemicals.
Independent reference data for (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate (CAS 425386-58-9), compiled from public chemistry databases.
| CAS 号 | 425386-58-9 |
|---|---|
| PubChem CID | 69249858 |
| 分子式 | C31H32N2O9 |
| IUPAC 名称 | (5S)-5-amino-3-methyl-2,5-dihydro-1H-3-benzazepin-4-one;(2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid |
| UNII（FDA） | C31H32N2O9 |
| Molecular Weight | 576.6 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 9 |
| Exact Mass | 576.21078060 |
| Monoisotopic Mass | 576.21078060 |
| Topological Polar Surface Area | 174 |
| Heavy Atom Count | 42 |
425386-58-9; (S)-1-amino-3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-methylbenzoyloxy)succinate; (S)-1-amino-3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis((4-methylbenzoyl)oxy)succinate; (5S)-5-amino-3-methyl-2,5-dihydro-1H-3-benzazepin-4-one;(2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid; (S)-1-amino-3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one(2R,3R)-2,3-bis(4-methylbenzoyloxy)succinate; C31H32N2O9; SCHEMBL4941582; CS-M1274; MFCD22124623; AKOS037649897; CS-13850; DB-236289; F986351; (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate-2
(S)-1-氨基-3-甲基-4,5-二氢-1H-苯并[d]氮杂-2(3H)-酮(2R,3R)-2,3-双((4-甲基苯甲酰基)氧基)琥珀酸 · CAS 425386-58-9 · C31H32N2O9. UNII C31H32N2O9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (S)-1-氨基-3-甲基-4,5-二氢-1H-苯并[d]氮杂-2(3H)-酮(2R,3R)-2,3-双((4-甲基苯甲酰基)氧基)琥珀酸