Cas no 77960-22-6 (3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel-)
77960-22-6 structure
Product Name:3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel-
CAS No:77960-22-6
MF:C17H17NO4
MW:299.321184873581
MDL:MFCD03660012
CID:551186
PubChem ID:304675
Update Time:2025-04-19
3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel- Chemical and Physical Properties
Names and Identifiers
-
- 3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel-
- 4-OXO-3-PHENETHYL-10-OXA-3-AZA-TRICYCLO[5.2.1.0(1,5)]DEC-8-ENE-6-CARBOXYLIC ACID
- 3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3...
- 4-Oxo-3-phenethyl-10-oxa-3-aza-tricyclo[5 .2.1.0*1,5*]dec-8-ene-6-carboxylic acid
- (3aR,6S,7R,7aS)-rel-1-Oxo-2-phenethyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
- Oprea1_263705
- 4-Oxo-3-phenethyl-10-oxa-3-aza-tricyclo[5.2.1.0]dec-8-ene-6-carboxylic acid
- 4-OXO-3-(2-PHENYLETHYL)-10-OXA-3-AZATRICYCLO[5.2.1.0(1),?]DEC-8-ENE-6-CARBOXYLIC ACID
- NSC201292
- AM-760/41582981
- 4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylic acid
- CS-0319430
- 77960-22-6
- CCG-115098
- FT-0676741
- AKOS000300747
- NSC-201292
- 4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxylic acid
- 4-Oxo-3-phenethyl-10-oxa-3-aza-tricyclo[5.2.1.0*1,5*]dec-8-ene-6-carboxylic acid
- AKOS022061396
- EU-0048959
- 1-Oxo-2-phenethyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
- HMS1487K04
- ChemDiv3_005152
- 4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[
- IDI1_023062
- VS-02441
- 4-oxo-3-phenethyl-10-oxa-3-aza-tricyclo[
- DTXSID70307997
- 1-oxo-2-(2-phenylethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
- Oprea1_384357
- BBL010319
- STK384080
-
- MDL： MFCD03660012
- Inchi： 1S/C17H17NO4/c19-15-14-13(16(20)21)12-6-8-17(14,22-12)10-18(15)9-7-11-4-2-1-3-5-11/h1-6,8,12-14H,7,9-10H2,(H,20,21)
- InChI Key： MPBLVPMGVIUHFH-UHFFFAOYSA-N
- SMILES： O1C2C=CC31CN(CCC1C=CC=CC=1)C(C3C2C(=O)O)=O
Computed Properties
- Exact Mass: 299.11600
- Monoisotopic Mass: 299.11575802g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 525
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.84000
- LogP: 1.03360
3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel- Security Information
-
Hazardous Material Identification：
- HazardClass：IRRITANT
3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1390100-1g |
1-Oxo-2-phenethyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid |
77960-22-6 | 97% | 1g |
￥2268.00 | 2024-07-28 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1390100-5g |
1-Oxo-2-phenethyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid |
77960-22-6 | 97% | 5g |
￥7361.00 | 2024-07-28 | |
| Chemenu | CM376916-1g |
4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.01,?]dec-8-ene-6-carboxylic acid |
77960-22-6 | 95%+ | 1g |
$*** | 2023-05-29 | |
| Chemenu | CM376916-5g |
4-oxo-3-(2-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.01,?]dec-8-ene-6-carboxylic acid |
77960-22-6 | 95%+ | 5g |
$*** | 2023-05-29 | |
| SHENG KE LU SI SHENG WU JI SHU | sc-316958-500mg |
4-Oxo-3-phenethyl-10-oxa-3-aza-tricyclo[5.2.1.0*1,5*]dec-8-ene-6-carboxylic acid, |
77960-22-6 | 500mg |
￥1805.00 | 2023-09-05 | ||
| SHENG KE LU SI SHENG WU JI SHU | sc-316958-500 mg |
4-Oxo-3-phenethyl-10-oxa-3-aza-tricyclo[5.2.1.0*1,5*]dec-8-ene-6-carboxylic acid, |
77960-22-6 | 500MG |
￥1,805.00 | 2023-07-11 |
3a,6-Epoxy-3aH-isoindole-7-carboxylicacid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-(2-phenylethyl)-, (3aR,6S,7R,7aS)-rel- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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