(S)-2-(1,3-Dioxo-1,3-Dihydro-isoindol-2-yl)-propionyl Chloride - CAS 4306-25-6
Catalog: |
BB066616 |
Product Name: |
(S)-2-(1,3-Dioxo-1,3-Dihydro-isoindol-2-yl)-propionyl Chloride |
CAS: |
4306-25-6 |
Synonyms: |
phthaloyl-L-alanine chloride; (2S)-2-(1,3-dioxoisoindol-2-yl)propanoyl chloride; (S)-2-(1,3-Dioxoisoindolin-2-yl)propanoyl chloride; N,N-Phthaloyl-L-alanine chloride; (s)-2-phthalimidopropionyl-chloride; (S)-2-phthalimidopropionyl chloride |
IUPAC Name: | (2S)-2-(1,3-dioxoisoindol-2-yl)propanoyl chloride |
Molecular Weight: | 237.6 |
Molecular Formula: | C11H8ClNO3 |
Canonical SMILES: | CC(C(=O)Cl)N1C(=O)C2=CC=CC=C2C1=O |
InChI: | InChI=1S/C11H8ClNO3/c1-6(9(12)14)13-10(15)7-4-2-3-5-8(7)11(13)16/h2-6H,1H3/t6-/m0/s1 |
InChI Key: | FVLYPXOSHYZOPT-LURJTMIESA-N |
Complexity: | 331 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.0192708 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.0192708 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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