Methyl 4-(Boc-aminomethyl)benzoate - CAS 120157-96-2
Catalog: |
BB004731 |
Product Name: |
Methyl 4-(Boc-aminomethyl)benzoate |
CAS: |
120157-96-2 |
Synonyms: |
4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid methyl ester; methyl 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate |
IUPAC Name: | methyl 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate |
Description: | Methyl 4-(Boc-aminomethyl)benzoate (CAS# 120157-96-2 ) is a useful research chemical. |
Molecular Weight: | 265.30 |
Molecular Formula: | C14H19NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)OC |
InChI: | InChI=1S/C14H19NO4/c1-14(2,3)19-13(17)15-9-10-5-7-11(8-6-10)12(16)18-4/h5-8H,9H2,1-4H3,(H,15,17) |
InChI Key: | UDPLKASYJHMKIP-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 2.70230 |
Publication Number | Title | Priority Date |
CN-112805000-A | 2-arylbenzimidazoles as PPARGC1A activators for the treatment of neurodegenerative diseases | 20180806 |
AU-2016299484-A1 | 1,3,4-oxadiazole sulfonamide derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same | 20150727 |
AU-2016299484-B2 | 1,3,4-oxadiazole sulfonamide derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same | 20150727 |
CA-2993929-A1 | 1,3,4-oxadiazole sulfonamide derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same | 20150727 |
EP-3328843-A1 | 1,3,4-oxadiazole sulfonamide derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same | 20150727 |
Complexity: | 314 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.13140809 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 64.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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