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D-Alanyl-L-phenylalanine

CAT: 0804-HY-W152405-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W152405-01Size:100 mg
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Description
D-Alanyl-L-phenylalanine (H-D-Ala-phe-OH) is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
CAS Number
3061-95-8
Product Name Alternative
H-D-Ala-phe-OH
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Smiles
C[C@@H](N)C(N[C@H](C(O)=O)CC1=CC=CC=C1)=O
Molecular Formula
C12H16N2O3
Molecular Weight
236.27
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

H-D-Ala-phe-OH
CAS Number3061-95-8
PubChem CID6992396
IUPAC Name(2S)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenylpropanoic acid
Molecular FormulaC12H16N2O3
Molecular Weight236.27
XLogP-2.5
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity275
SMILES
C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)N
InChI
InChI=1S/C12H16N2O3/c1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)/t8-,10+/m1/s1
InChIKey
OMNVYXHOSHNURL-SCZZXKLOSA-N
Chemical Structure
2D Structure
2D structure of H-D-Ala-phe-OH
CAS: 3061-95-8
CID: 6992396
Formula: C12H16N2O3
MW: 236.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight236.27
XLogP3-2.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass236.11609238
Monoisotopic Mass236.11609238
Topological Polar Surface Area92.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity275
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes