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Boc-D-4-Pal-OH

CAT: 0804-HY-W009402-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W009402-01Size:1 g
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Description
Boc-D-4-Pal-OH is an alanine derivative[1].
CAS Number
37535-58-3
UNSPSC
12352209
Hazard Statement
H315, H319, H335
Target
Amino Acid Derivatives
Type
Peptides
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/boc-d-4-pal-oh.html
Purity
98.23
Solubility
DMSO : 40 mg/mL (ultrasonic)
Smiles
O=C([C@@H](CC1=CC=NC=C1)NC(OC(C)(C)C)=O)O
Molecular Formula
C13H18N2O4
Molecular Weight
266.29
Precautions
H315, H319, H335
References & Citations
[1]Luckose F, et al. Effects of amino acid derivatives on physical, mental, and physiological activities. Crit Rev Food Sci Nutr. 2015;55 (13) :1793-1120.
Shipping Conditions
Blue Ice
Storage Conditions
-80°C, 2 years; -20°C, 1 year (Powder, sealed storage, away from moisture)
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

Boc-3-(4-pyridyl)-D-alanine
CAS Number37535-58-3
PubChem CID2734503
IUPAC Name(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-ylpropanoic acid
Molecular FormulaC13H18N2O4
Molecular Weight266.29
XLogP1.4
Topological Polar Surface Area88.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity319
SMILES
CC(C)(C)OC(=O)N[C@H](CC1=CC=NC=C1)C(=O)O
InChI
InChI=1S/C13H18N2O4/c1-13(2,3)19-12(18)15-10(11(16)17)8-9-4-6-14-7-5-9/h4-7,10H,8H2,1-3H3,(H,15,18)(H,16,17)/t10-/m1/s1
InChIKey
FNYWDMKESUACOU-SNVBAGLBSA-N
Chemical Structure
2D Structure
2D structure of Boc-3-(4-pyridyl)-D-alanine
CAS: 37535-58-3
CID: 2734503
Formula: C13H18N2O4
MW: 266.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight266.29
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass266.12665706
Monoisotopic Mass266.12665706
Topological Polar Surface Area88.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity319
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes