2-tert-Butoxycarbonylamino-3-pyridin-2-yl-propionic acid

HCID 4546342
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Basic information

CAS
119434-71-8
Standard SMILES
CC(C)(C)OC(=O)NC(Cc1ccccn1)C(=O)O
InChIKey
KMODKKCXWFNEIK-UHFFFAOYSA-N
Molecular formula
C13H18N2O4
Average molar mass
266.29 g/mol
Monoisotopic mass
266.12665706

Names & identifiers

Preferred name
2-tert-Butoxycarbonylamino-3-pyridin-2-yl-propionic acid
IUPAC
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-ylpropanoic acid
English name
Boc-DL-2-pyridylalanine
Molecular formula
C13H18N2O4
Molecular weight
266.29

Names & synonyms

119434-71-82-tert-Butoxycarbonylamino-3-pyridin-2-yl-propionic acidDTXSID70404112RefChem:267071DTXCID703549662-((Tert-Butoxycarbonyl)amino)-3-(pyridin-2-yl)propanoic acidBoc-DL-2-pyridylalanine2-{[(tert-butoxy)carbonyl]amino}-3-(pyridin-2-yl)propanoic acid2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-ylpropanoic acid2-{[(tert-Butoxy)carbonyl]amino}-3-(pyridin-2-yl)-propanoic acidMFCD020944422-([(TERT-BUTOXY)CARBONYL]AMINO)-3-(PYRIDIN-2-YL)PROPANOIC ACID
Show more names
2-(Boc-amino)-3-(2-pyridyl)propanoic AcidN-α-(t-Butoxycarbonyl)-β-(2-pyridyl)-DL-alanine(±)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-pyridinepropanoic Acid2-Pyridinepropanoicacid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-(9CI)2-Pyridinepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]- (9CI)2-Pyridinepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (±)-
BOC-3-(2'-PYRIDYL)-L-ALANINE2-(tert-butoxycarbonylamino)-3-(2-pyridyl)propanoic acidBoc-D-3-(2-pyridyl)-alanineBoc-DL-Ala(2-Pyri)-OHBoc-3-(2-Pyridyl)-DL-alanineKMODKKCXWFNEIK-UHFFFAOYSA-NBoc-Ala(2-pyridyl)-OHSCHEMBL215179

Database identifiers

CAS
119434-71-8
PubChem CID
4546342
DTXSID
DTXSID70404112

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
88.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
19

Physicochemical properties

Boiling point
436.9 · 436.9±40.0 °C(Predicted)
Density
1.2 · 1.200±0.06 g/cm3(Predicted)
storage temp.
Inert atmosphere,Room Temperature
pka
3.09 · 3.09±0.10(Predicted)
Appearance
Light yellow to yellow Solid
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P301+P312

Chemistry & industry

Applications

Uses(±)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-pyridinepropanoic Acid is a useful reagent for organic synthesis.

Suppliers20 total

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]

Related reactions

9 records
New reaction record

Compound notes

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