![(S)-2-[(S)-2-((S)-1-Ethoxycarbonyl-3-phenylpropylamino)propionyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid benzyl ester structure, CAS 82637-57-8](/structures/60000/48782_1_82637_57_8.png)
CAS Number82637-57-8
SynonymsPropanedinitrile,2-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylene]; {3-Methoxy-4-[bis-(2-chlor-ethyl)-amino]-benzyliden}-malononitril
Molecular FormulaC34H40N2O7
Molecular Weight670.75
Purity98.00%
Density1.191g/cm3
Boiling Point738.4ºC at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 82637-57-8 |
| Catalog No. | 2A-9048782 |
| Chinese Name | (S)-2-[(S)-2-((S)-1-乙氧羰基-3-苯基丙基氨基)丙酰基]-6,7-二甲氧基-1,2,3,4-四氢异喹啉-3-甲酸苄酯 |
| Synonyms | Propanedinitrile,2-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylene]; {3-Methoxy-4-[bis-(2-chlor-ethyl)-amino]-benzyliden}-malononitril |
| Molecular Formula | C34H40N2O7 |
| Molecular Weight | 670.75 |
| Purity | 98.00 |
| Density | 1.191g/cm3 |
| Boiling Point | 738.4ºC at 760 mmHg |
| PubChem ID | 90307376 |
| MDL Number | MFCD29045605 |
| SMILES | N2([C@@H](Cc3c(cc(c(c3)OC)OC)C2)C(=O)OC(C)(C)C)C(=O)[C@@H](N[C@@H](CCc1ccccc1)C(=O)OCC)C.OC(=O)\C=C/C(=O)O |
| InChI | 1S/C31H42N2O7.C4H4O4/c1-8-39-29(35)24(15-14-21-12-10-9-11-13-21)32-20(2)28(34)33-19-23-18-27(38-7)26(37-6)17-22(23)16-25(33)30(36)40-31(3,4)5;5-3(6)1-2-4(7)8/h9-13,17-18,20,24-25,32H,8,14-16,19H2,1-7H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t20-,24-,25-;/m0./s1 |
| InChI Key | SMLOIRKJVBQPQD-SAYMYIPQSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/48782_1_82637_57_8.pdf |
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