Basic information
- CAS
886364-72-3- Standard SMILES
Cc1ccc(CC(CN(C)C(=O)OC(C)(C)C)C(=O)O)cc1- InChIKey
WOSCOMOICKCSAJ-UHFFFAOYSA-N- Molecular formula
- C17H25NO4
- Average molar mass
- 307.4 g/mol
- Monoisotopic mass
- 307.17835828
Names & identifiers
- Preferred name
- 2-{[(tert-Butoxycarbonyl)(methyl)amino]methyl}-3-(4-methylphenyl)propanoic acid
- IUPAC
- 2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-(4-methylphenyl)propanoic acid
- English name
- 2-N-Boc-2-methylaminomethyl-3-p-tolyl-propionic acid
- Molecular formula
- C17H25NO4
- Molecular weight
- 307.38
Names & synonyms
886364-72-33-((tert-Butoxycarbonyl)(methyl)amino)-2-(4-methylbenzyl)propanoic acid2-{[(tert-Butoxycarbonyl)(methyl)amino]methyl}-3-(4-methylphenyl)propanoic acid2-n-boc-2-methylaminomethyl-3-p-tolyl-propionic acidDTXSID70661440AKOS0253124882-N-Boc-2-methylaminomethyl-3-p-tolylpropionic acid2-[(tert-butoxycarbonyl-methyl-amino)-methyl]-3-p-tolyl-propionic acid3-((tert-Butoxycarbonyl)(methyl)amino)-2-(4-methylbenzyl)propanoicacid2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-(4-methylphenyl)propanoic acid2-N-Boc-2-Methylaminomethyl-3-p-tolyl-propionic acid, CAS 886364-72-3Benzenepropanoic acid, α-[[[(1,1-dimethylethoxy)carbonyl]methylamino]methyl]-4-methyl-
Show more names
Benzenepropanoic acid, .alpha.-[[[(1,1-dimethylethoxy)carbonyl]methylamino]methyl]-4-methyl-
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 381
Chemistry & industry
Suppliers4 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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