hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one (CAS 71592-44-4) — formula C13H17NO2, molecular weight 219.28; category organic chemicals.
| CAS Number | 71592-44-4 |
|---|---|
| Molecular Formula | C13H17NO2 |
| Molecular Weight | 219.28 |
| LogP | 1.8 |
| Category | Organic Chemicals |
hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one is a carbon-based organic compound with CAS registry number 71592-44-4 and molecular formula C13H17NO2 (molecular weight 219.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 71592-44-4
Its molecular formula C13H17NO2 comprises 13 C, 17 H, 1 N, 2 O atoms.
Also known as: hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one · 六氢-3-(3-羟基苯基)-1-甲基-2H-氮杂卓-2-酮
Category: organic chemicals
The CAS registry number of hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one is 71592-44-4.
Molecular formula C13H17NO2, molecular weight 219.28.
It is also registered under: hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one, 六氢-3-(3-羟基苯基)-1-甲基-2H-氮杂卓-2-酮.
Category: Organic Chemicals.
Independent reference data for hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one (CAS 71592-44-4), compiled from public chemistry databases.
| CAS 号 | 71592-44-4 |
|---|---|
| PubChem CID | 11746121 |
| 分子式 | C13H17NO2 |
| IUPAC 名称 | 3-(3-hydroxyphenyl)-1-methylazepan-2-one |
| UNII（FDA） | NS00061192 |
| Molecular Weight | 219.28 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 219.125928785 |
| Monoisotopic Mass | 219.125928785 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 16 |
71592-44-4; Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one; EINECS 275-650-3; RefChem:146041; 275-650-3; 3-(3-Hydroxyphenyl)-1-methylazepan-2-one; SCHEMBL7678578; DTXSID10992144; AKOS022173300; AC-24408; DA-17675; NS00061192; 3-(3-hydroxy-phenyl)-1-methyl-azepan-2-one; Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepine-2-one
六氢-3-(3-羟基苯基)-1-甲基-2H-氮杂卓-2-酮 · CAS 71592-44-4 · C13H17NO2. UNII NS00061192.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.