5,7-Dichloro-2-trityl-1,2,3,4-tetrahydroisoquinoline - CAS 1289646-72-5
Catalog: |
BB006956 |
Product Name: |
5,7-Dichloro-2-trityl-1,2,3,4-tetrahydroisoquinoline |
CAS: |
1289646-72-5 |
Synonyms: |
5,7-dichloro-2-(triphenylmethyl)-3,4-dihydro-1H-isoquinoline; 5,7-dichloro-2-trityl-3,4-dihydro-1H-isoquinoline |
IUPAC Name: | 5,7-dichloro-2-trityl-3,4-dihydro-1H-isoquinoline |
Description: | 5,7-Dichloro-2-trityl-1,2,3,4-tetrahydroisoquinoline (CAS# 1289646-72-5 ) is a useful research chemical. |
Molecular Weight: | 444.39 |
Molecular Formula: | C28H23Cl2N |
Canonical SMILES: | C1CN(CC2=CC(=CC(=C21)Cl)Cl)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5 |
InChI: | InChI=1S/C28H23Cl2N/c29-25-18-21-20-31(17-16-26(21)27(30)19-25)28(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,18-19H,16-17,20H2 |
InChI Key: | GNJLKXCOYZKBEG-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 7.28150 |
Publication Number | Title | Priority Date |
US-10273212-B2 | Continuous flow carboxylation reaction | 20140925 |
US-2016090361-A1 | Continuous flow carboxylation reaction | 20140925 |
US-2018118689-A1 | Continuous flow carboxylation reaction | 20140925 |
US-2019300485-A1 | Continuous flow carboxylation reaction | 20140925 |
US-9725413-B2 | Continuous flow carboxylation reaction | 20140925 |
Complexity: | 516 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 443.1207551 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 443.1207551 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 3.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.7 |
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