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3-Hydroxy-D-valine, N-BOC protected

CAT: 0127-OR307093-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR307093-01Size:100 mg
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CAS Number
288159-40-0
Synonyms
N- (tert-Butoxycarbonyl) -3-hydroxy-D-valine, (2R) -2-[ (tert-Butoxycarbonyl) amino]-3-hydroxy-3-methylbutanoic acid
MDL Number
MFCD02682576
Purity
95%
Smiles
CC(C)(C)OC(=O)N[C@@H](C(=O)O)C(C)(C)O

Chemical Information

N-(tert-Butoxycarbonyl)-3-hydroxy-D-valine
CAS Number288159-40-0
PubChem CID11299247
IUPAC Name(2R)-3-hydroxy-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Molecular FormulaC10H19NO5
Molecular Weight233.26
XLogP0.5
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity279
SMILES
CC(C)(C)OC(=O)N[C@@H](C(=O)O)C(C)(C)O
InChI
InChI=1S/C10H19NO5/c1-9(2,3)16-8(14)11-6(7(12)13)10(4,5)15/h6,15H,1-5H3,(H,11,14)(H,12,13)/t6-/m0/s1
InChIKey
SZVRVSZFEDIMFM-LURJTMIESA-N
Chemical Structure
2D Structure
2D structure of N-(tert-Butoxycarbonyl)-3-hydroxy-D-valine
CAS: 288159-40-0
CID: 11299247
Formula: C10H19NO5
MW: 233.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight233.26
XLogP30.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass233.12632271
Monoisotopic Mass233.12632271
Topological Polar Surface Area95.9 Ų
Heavy Atom Count16
Formal Charge0
Complexity279
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