Basic information
- CAS
1160248-39-4- Standard SMILES
CC(C)(C)OC(=O)N1CCC(C2CN(C(=O)OCc3ccccc3)c3ccccc32)CC1- InChIKey
TVGSNCABPGIPSN-UHFFFAOYSA-N- Molecular formula
- C26H32N2O4
- Average molar mass
- 436.5 g/mol
- Monoisotopic mass
- 436.23620751
Names & identifiers
- Preferred name
- Benzyl 3-(1-(tert-butoxycarbonyl)piperidin-4-yl)indoline-1-carboxylate
- IUPAC
- benzyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-2,3-dihydroindole-1-carboxylate
- English name
- Benzyl 3-(1-(Tert-Butoxycarbonyl)Piperidin-4-Yl)Indoline-1-Carboxylate
- Molecular formula
- C26H32N2O4
- Molecular weight
- 436.54
Names & synonyms
1160248-39-4Benzyl 3-(1-(tert-butoxycarbonyl)piperidin-4-yl)indoline-1-carboxylateMFCD12198807benzyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-2,3-dihydroindole-1-carboxylatebenzyl 3-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-2,3-dihydro-1H-indole-1-carboxylatebenzyl3-(1-(tert-butoxycarbonyl)piperidin-4-yl)indoline-1-carboxylateAKOS027428878SB65887AS-72687W15155Benzyl 3-(1-(t-butoxycarbonyl)piperidin-4-yl)indoline-1-carboxylatebenzyl 3-(1-tert-butoxycarbonyl-4-piperidyl)indoline-1-carboxylate
Show more names
Benzyl 3-(1-(Tert-Butoxycarbonyl)Piperidin-4-Yl)Indoline-1-Carboxylate(WX175012)1H-Indole-1-carboxylic acid, 3-[1-[(1,1-dimethylethoxy)carbonyl]-4-piperidinyl]-2,3-dihydro-, phenylmethyl ester
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 647
Physicochemical properties
- Boiling point
- 544.6 · 544.6±50.0 °C(Predicted)
- Density
- 1.191 · 1.191±0.06 g/cm3(Predicted)
- pka
- 0.67 · 0.67±0.40(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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