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N-Cbz-D-alanine

CAT: 0572-TRC-C227100-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C227100-25GSize:25 g
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CAS Number
26607-51-2
Synonyms
N-[(Phenylmethoxy)carbonyl]-D-alanine; N-Carboxy-D-alanine N-Benzyl Ester; (2R)-2-[[(Benzyloxy)carbonyl]amino]propanoic Acid; (R)-2-(Benzyloxycarbonylamino)propanoic Acid; (R)-2-[(Benzyloxycarbonyl)amino]propionic Acid; Benzyloxycarbonyl-D-alanine; CBZ-D-Alanine; D-Carbobenzoxyalanine; D-N-(Benzyloxycarbonyl)alanine; N-(Benzyloxycarbonyl)-D-alanine; N-Carbobenzoxy-D-alanine; N-Carbobenzyloxy-D-alanine; NSC 523825; Z-D-Alanine
Hazard Statement
No Data Available
Smiles
C[C@@H](NC(=O)OCc1ccccc1)C(=O)O
Molecular Formula
C11H13NO4
Molecular Weight
223.23
Shipping Conditions
Room Temperature

Chemical Information

N-Cbz-d-alanine
CAS Number26607-51-2
PubChem CID70832
IUPAC Name(2R)-2-(phenylmethoxycarbonylamino)propanoic acid
Molecular FormulaC11H13NO4
Molecular Weight223.22
XLogP1.4
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity248
SMILES
C[C@H](C(=O)O)NC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C11H13NO4/c1-8(10(13)14)12-11(15)16-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,15)(H,13,14)/t8-/m1/s1
InChIKey
TYRGLVWXHJRKMT-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of N-Cbz-d-alanine
CAS: 26607-51-2
CID: 70832
Formula: C11H13NO4
MW: 223.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight223.22
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass223.08445790
Monoisotopic Mass223.08445790
Topological Polar Surface Area75.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity248
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