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H-D-Trp-OEt.HCl

CAT: 0607-A6734-25000Size: 25 gDry Ice: NoHazardous: No
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CAT#:0607-A6734-25000Size:25 g
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CAS Number
7479-05-2
Product Name Alternative
ethyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate;hydrochloride
Purity
0.98
Smiles
CCOC(=O)C(CC1=CNC2=CC=CC=C21)N.Cl
Molecular Formula
C13H17ClN2O2
Molecular Weight
268.74
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

L-Tryptophan, ethyl ester
CAS Number7479-05-2
PubChem CID81996
IUPAC Nameethyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate
Molecular FormulaC13H16N2O2
Molecular Weight232.28
XLogP1.9
Topological Polar Surface Area68.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity270
SMILES
CCOC(=O)[C@H](CC1=CNC2=CC=CC=C21)N
InChI
InChI=1S/C13H16N2O2/c1-2-17-13(16)11(14)7-9-8-15-12-6-4-3-5-10(9)12/h3-6,8,11,15H,2,7,14H2,1H3/t11-/m0/s1
InChIKey
DABYEOZXRSTEGL-NSHDSACASA-N
Chemical Structure
2D Structure
2D structure of L-Tryptophan, ethyl ester
CAS: 7479-05-2
CID: 81996
Formula: C13H16N2O2
MW: 232.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.28
XLogP31.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass232.121177757
Monoisotopic Mass232.121177757
Topological Polar Surface Area68.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity270
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

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