Benzyl (Chloromethyl) Succinate - CAS 143869-67-4
Catalog: |
BB009680 |
Product Name: |
Benzyl (Chloromethyl) Succinate |
CAS: |
143869-67-4 |
Synonyms: |
butanedioic acid O4-(chloromethyl) ester O1-(phenylmethyl) ester; 1-O-benzyl 4-O-(chloromethyl) butanedioate |
IUPAC Name: | 1-O-benzyl 4-O-(chloromethyl) butanedioate |
Description: | Benzyl (Chloromethyl) Succinate (CAS# 143869-67-4 ) is a useful research chemical. |
Molecular Weight: | 256.68 |
Molecular Formula: | C12H13ClO4 |
Canonical SMILES: | C1=CC=C(C=C1)COC(=O)CCC(=O)OCCl |
InChI: | InChI=1S/C12H13ClO4/c13-9-17-12(15)7-6-11(14)16-8-10-4-2-1-3-5-10/h1-5H,6-9H2 |
InChI Key: | CSQJMNMWWYYBBG-UHFFFAOYSA-N |
LogP: | 2.24950 |
Publication Number | Title | Priority Date |
WO-2018121678-A1 | Prodrug of antiviral nucleoside analogues, and composition and use thereof | 20161229 |
US-2011034434-A1 | Prodrugs of fused heterocyclic inhibitors of d-amino acid oxidase | 20090807 |
AU-2008351147-A1 | Novel diazeniumdiolate derivatives, method for the preparation thereof and pharmaceutical compositions containing the same | 20071211 |
AU-2008351147-B2 | Novel diazeniumdiolate derivatives, method for the preparation thereof and pharmaceutical compositions containing the same | 20071211 |
CA-2707853-A1 | Novel diazeniumdiolate derivatives, method for the preparation thereof and pharmaceutical compositions containing the same | 20071211 |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 256.0502366 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.0502366 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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