Cas no 10479-68-2 (rac-(3aR,7aS)-octahydro-1H-isoindol-1-one)
10479-68-2 structure
Product Name:rac-(3aR,7aS)-octahydro-1H-isoindol-1-one
CAS No:10479-68-2
MF:C8H13NO
MW:139.194922208786
MDL:MFCD19687288
CID:198792
PubChem ID:13039545
Update Time:2025-09-23
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one Chemical and Physical Properties
Names and Identifiers
-
- 1H-Isoindol-1-one,octahydro-, (3aR,7aS)-rel-
- 2,3,3a,4,5,6,7,7a-octahydroisoindol-1-one
- cis-octahydro-1H-isoindol-1-one
- (+-)-cis-octahydro-isoindol-1-one
- 1H-Isoindol-1-one, octahydro-
- AC1L3ALV
- AC1Q6GWB
- AGN-PC-00KKX9
- cis-Hexahydrophthalimidin
- cis-Hexahydro-phthalimidin
- NSC338089
- octahydro-1h-isoindol-1-one
- SureCN258503
- SureCN8789437
- (3aR,7aS)-rel-octahydro-1H-Isoindol-1-one (Relative struc)
- rac-(3aR,7aS)-octahydro-1H-isoindol-1-one
- DTXSID70909213
- NSC-338089
- D76636
- JKYNCKNIVHDOKU-UHFFFAOYSA-N
- 2555-11-5
- octahydro-isoindol-1-one
- AKOS006328953
- SCHEMBL258503
- (3Ar,7aS)-2,3,3a,4,5,6,7,7a-octahydroisoindol-1-one
- EINECS 233-980-5
- CS-0106297
- CAA55511
- perhydroisoindolone
- 3a,4,5,6,7,7a-Hexahydro-1H-isoindol-3-ol
- 10479-68-2
- EN300-637422
-
- MDL： MFCD19687288
- Inchi： 1S/C8H13NO/c10-8-7-4-2-1-3-6(7)5-9-8/h6-7H,1-5H2,(H,9,10)
- InChI Key： JKYNCKNIVHDOKU-UHFFFAOYSA-N
- SMILES： O=C1C2CCCCC2CN1
Computed Properties
- Exact Mass: 139.09979
- Monoisotopic Mass: 139.099714
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 155
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 29.1
- XLogP3: 1.1
Experimental Properties
- Density: 1.044
- Boiling Point: 308.5°Cat760mmHg
- Flash Point: 176.8°C
- Refractive Index: 1.488
- PSA: 29.1
- LogP: 1.19850
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-814103-1g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 90% | 1g |
$914.0 | 2023-09-02 | |
| Enamine | EN300-814103-5g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 90% | 5g |
$2650.0 | 2023-09-02 | |
| Enamine | EN300-814103-10g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 90% | 10g |
$3929.0 | 2023-09-02 | |
| Enamine | EN300-814103-0.05g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 0.05g |
$212.0 | 2025-03-21 | |
| Enamine | EN300-814103-0.1g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 0.1g |
$317.0 | 2025-03-21 | |
| Enamine | EN300-814103-0.25g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 0.25g |
$452.0 | 2025-03-21 | |
| Enamine | EN300-814103-0.5g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 0.5g |
$713.0 | 2025-03-21 | |
| Enamine | EN300-814103-1.0g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 1.0g |
$914.0 | 2025-03-21 | |
| Enamine | EN300-814103-2.5g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 2.5g |
$1791.0 | 2025-03-21 | |
| Enamine | EN300-814103-5.0g |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one |
10479-68-2 | 95.0% | 5.0g |
$2650.0 | 2025-03-21 |
rac-(3aR,7aS)-octahydro-1H-isoindol-1-one Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
10479-68-2 (rac-(3aR,7aS)-octahydro-1H-isoindol-1-one) Related Products
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