Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))- (CAS 62314-70-9) — formula C44H54O6, molecular weight 678.9; category organic chemicals.
| CAS Number | 62314-70-9 |
|---|---|
| Molecular Formula | C44H54O6 |
| Molecular Weight | 678.9 |
| LogP | 11.8 |
| Category | Organic Chemicals |
Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))- is a carbon-based organic compound with CAS registry number 62314-70-9 and molecular formula C44H54O6 (molecular weight 678.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 62314-70-9
Its molecular formula C44H54O6 comprises 44 C, 54 H, 6 O atoms.
Also known as: Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))- · 乙酸，((5-甲基-2-(1-甲基乙基)环己基)氧基)-，7,8-二氢苯并(a)芘-7,8-二酯，(1R-(1α(7S*,8S*(1R*,2S*,5R*)),2β,5α))-
Category: organic chemicals
The CAS registry number of Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))- is 62314-70-9.
Molecular formula C44H54O6, molecular weight 678.9.
It is also registered under: Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))-, 乙酸，((5-甲基-2-(1-甲基乙基)环己基)氧基)-，7,8-二氢苯并(a)芘-7,8-二酯，(1R-(1α(7S*,8S*(1R*,2S*,5R*)),2β,5α))-.
Category: Organic Chemicals.
Independent reference data for Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 7,8-dihydro benzo(a)pyrene-7,8-diyl ester, (1R-(1alpha(7S*,8S*(1R*,2S*,5R*)),2beta ,5alpha))- (CAS 62314-70-9), compiled from public chemistry databases.
| CAS 号 | 62314-70-9 |
|---|---|
| PubChem CID | 148998 |
| 分子式 | C44H54O6 |
| IUPAC 名称 | [7-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetyl]oxy-7,8-dihydrobenzo[a]pyren-8-yl] 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetate |
| Molecular Weight | 678.9 |
|---|---|
| XLogP3 | 11.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 12 |
| Exact Mass | 678.39203944 |
| Monoisotopic Mass | 678.39203944 |
| Topological Polar Surface Area | 71.1 |
| Heavy Atom Count | 50 |
62314-70-9; trans(+)-7,8-Dihydroxy-7,8-dihydrobenzo(a)pyrene di(-)-methoxyacetate; DTXSID10977870; 63268-14-4; 97388-52-8; 7,8-Dihydrobenzo[pqr]tetraphene-7,8-diyl bis({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}acetate)
乙酸，((5-甲基-2-(1-甲基乙基)环己基)氧基)-，7,8-二氢苯并(a)芘-7,8-二酯，(1R-(1α(7S*,8S*(1R*,2S*,5R*)),2β,5α))- · CAS 62314-70-9 · C44H54O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 乙酸，((5-甲基-2-(1-甲基乙基)环己基)氧基)-，7,8-二氢苯并(a)芘-7,8-二酯，(1R-(1α(7S*,8S*(1R*,2S*,5R*)),2β,5α))-