Cas no 237073-64-2 (1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)-)
237073-64-2 structure
Product Name:1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)-
CAS No:237073-64-2
MF:C24H41NO6
MW:439.585448026657
CID:245480
PubChem ID:44181891
Update Time:2025-04-19
1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)-
- 1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1),
- azanium,7-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
- LOVASTATIN AMMONIUM SALT
- I06-0448
- DTXSID60657731
- FT-0644082
- ammonium 7-{2,6-dimethyl-8-[(2-methylbutanoyl)oxy]-1,2,6,7,8,8a-hexahydronaphthalen-1-yl}-3,5-dihydroxyheptanoate
- ammonium 7-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxy-heptanoate
- 237073-64-2
- azanium;7-[2, 6-dimethyl-8-(2-methylbutanoyloxy)-1, 2, 6, 7, 8, 8a-hexahydronaphthalen-1-yl]-3, 5-dihydroxyheptanoate
- ammonium 7-[2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
- A816860
-
- Inchi： 1S/C24H38O6.H3N/c1-5-15(3)24(29)30-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-18(25)12-19(26)13-22(27)28;/h6-7,10,14-16,18-21,23,25-26H,5,8-9,11-13H2,1-4H3,(H,27,28);1H3
- InChI Key： AOIIYQZTRFOGNN-UHFFFAOYSA-N
- SMILES： O(C(C(C)CC)=O)C1CC(C)C=C2C=CC(C)C(CCC(CC(CC(=O)[O-])O)O)C12.[NH4+]
Computed Properties
- Exact Mass: 439.29300
- Monoisotopic Mass: 439.293
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 31
- Rotatable Bond Count: 10
- Complexity: 649
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 8
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 108A^2
Experimental Properties
- PSA: 107.30000
- LogP: 4.03950
1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)- Security Information
- Hazard Category Code： 36/37/38
- Safety Instruction： 26-36/37/39
-
Hazardous Material Identification：
1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)- Pricemore >>
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1-Naphthaleneheptanoicacid, 1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-8-(2-methyl-1-oxobutoxy)-,ammonium salt (1:1), (bR,dR,1S,2S,6R,8S,8aR)- Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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