My Cart
0
You have no items in your shopping cart.
SKU | Size | Availability | Price | Qty |
---|---|---|---|---|
B300425-100mg | 100mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $481.90 |
Discover 2-Isocyano-3-Phenylpropionic Acid Methyl Ester by Aladdin Scientific in 95% for only $481.90. Available - in Ligands at Aladdin Scientific. Tags: .
Synonyms | methyl 2-isocyano-3-phenylpropanoate | 2-Isocyano-3-phenylpropionic acid methyl ester | 63157-14-2 | 112790-04-2 | SCHEMBL1274306 | DTXSID30370501 | CEPQFHINGYLWCQ-UHFFFAOYSA-N | Methyl 2-isocyano-3-phenylpropionate | GS-0326 | 2-Isocyano-3-phenyl-propionic acid methyl est |
---|---|
Specifications & Purity | ≥95% |
Storage Temp | Store at 2-8°C |
Shipped In | Wet ice |
IUPAC Name | methyl 2-isocyano-3-phenylpropanoate |
---|---|
INCHI | InChI=1S/C11H11NO2/c1-12-10(11(13)14-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,2H3 |
InChi Key | CEPQFHINGYLWCQ-UHFFFAOYSA-N |
Canonical SMILES | COC(=O)C(CC1=CC=CC=C1)[N+]#[C-] |
Isomeric SMILES | COC(=O)C(CC1=CC=CC=C1)[N+]#[C-] |
PubChem CID | 2734779 |
Molecular Weight | 189.21 |
Molecular Weight | 189.210 g/mol |
---|---|
XLogP3 | 2.000 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 189.079 Da |
Monoisotopic Mass | 189.079 Da |
Topological Polar Surface Area | 30.700 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 235.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 0 |
Covalently-Bonded Unit Count | 1 |