- 7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one
- 7-Chloro-1,2,3,4-tetrahydro-1-[(4-methylphenyl)sulfonyl]-5H-1-benzazepin-5-one
- 7-Chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one
- 7-Chloro-1,2,3,4-tetrahydroisoquinoline
- 7-Chloro-1,2,3,4-tetrahydroisoquinoline
- 7-Chloro-1,2,3,4-tetrahydronaphthalen-2-amine
- 7-Chloro-1,3-dihydro-5-phenyl-1-trimethylsilyl-2H-1,4-benzodiazepin-2-one
- 7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepine-2-thione
- 7-Chloro-1,5-naphthyridin-2(1H)-one
- 7-Chloro-10-(2-(dimethylamino)ethyl)isoalloxazine sulfate
- 13798-75-9L-Aspartic acid,N-[(1,1-dimethylethoxy)carbonyl]-, 1-(2,5-dioxo-1-pyrrolidinyl)4-(phenylmethyl) ester
- 13799-03-610H-Phenothiazine-2-aceticacid, 7-methoxy-a,10-dimethyl-
- 137-99-5Phenol, 2,4-dinonyl-
- 13799-90-11,4-Benzenedicarboxylicacid, 2,5-dichloro-
- 137999-85-0Benzenemethanol, a-[2-(methylamino)ethyl]-,hydrochloride (1:1), (aR)-
- 138000-94-92H-Imidazole-4-carboxylicacid, 2,2-dimethyl-, methyl ester, 1-oxide
- 138-00-1Phenol, 2,4-dipentyl-
- 138006-41-4Pyridine,3-bromo-2,5-dichloro-
- 138007-24-64-Piperidinecarboxylic acid tert-butyl ester
- 138008-97-62-Isopropoxyphenylboronic acid
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one |
EINECS | 1592732-453-0 |
| CAS No. | 137982-91-3 | Density | 1.387 g/cm3 |
| PSA | 83.20000 | LogP | 4.76810 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C18H15ClN2O4 | Boiling Point | 573.345 °C at 760 mmHg |
| Molecular Weight | 358.781 | Flash Point | 300.548 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
7-Chloro-1-(2-methyl-4-nitrobenzoyl)-1,2,3,4-tetrahydro-5H-1-benzazepin-5-one; |
Article Data | 9 |
7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one Specification
With the CAS registry number 137982-91-3, the systematic name of 7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one is 7-chloro-1-(2-methyl-4-nitrobenzoyl)-1,2,3,4-tetrahydro-5H-1-benzazepin-5-one. The product's category is Pharmaceutical Intermediates. In addition, its molecular formula is C18H15ClN2O4 and molecular weight is 358.78.
The other characteristics of 7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one can be summarized as: (1)ACD/LogP: 3.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.75; (4)ACD/LogD (pH 7.4): 3.75; (5)ACD/BCF (pH 5.5): 413.54; (6)ACD/BCF (pH 7.4): 413.54; (7)ACD/KOC (pH 5.5): 2597.2; (8)ACD/KOC (pH 7.4): 2597.2; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 83.2 Å2; (13)Index of Refraction: 1.635; (14)Molar Refractivity: 92.64 cm3; (15)Molar Volume: 258.6 cm3; (16)Polarizability: 36.72×10-24cm3; (17)Surface Tension: 58.6 dyne/cm; (18)Density: 1.387 g/cm3; (19)Flash Point: 300.5 °C; (20)Enthalpy of Vaporization: 85.93 kJ/mol; (21)Boiling Point: 573.3 °C at 760 mmHg; (22)Vapour Pressure: 3.75E-13 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES: [O-][N+](=O)c1ccc(c(C)c1)C(=O)N3CCCC(=O)c2cc(Cl)ccc23
(2)InChI: InChI=1/C18H15ClN2O4/c1-11-9-13(21(24)25)5-6-14(11)18(23)20-8-2-3-17(22)15-10-12(19)4-7-16(15)20/h4-7,9-10H,2-3,8H2,1H3
(3)InChIKey: NNCRQBJNAGEBDM-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C18H15ClN2O4/c1-11-9-13(21(24)25)5-6-14(11)18(23)20-8-2-3-17(22)15-10-12(19)4-7-16(15)20/h4-7,9-10H,2-3,8H2,1H3
(5)Std. InChIKey: NNCRQBJNAGEBDM-UHFFFAOYSA-N
What can I do for you?
Get Best Price
