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Boc-N-Me-Ala-OH

CAT: 0607-A7522-25000Size: 25 gDry Ice: NoHazardous: No
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CAT#:0607-A7522-25000Size:25 g
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CAS Number
16948-16-6
Product Name Alternative
(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
Field of Research
Amino Acids & Building Blocks N-Methyl Amino Acids
Purity
0.98
Solubility
Soluble in water or 1% acetic acid
Smiles
CC(C(=O)O)N(C)C(=O)OC(C)(C)C
Molecular Formula
C9H17NO4
Molecular Weight
203.2
Shipping Conditions
Blue ice
Storage Conditions
Desiccate at -20°C.

Chemical Information

(2S)-2-(((tert-butoxy)carbonyl)(methyl)amino)propanoic acid
CAS Number16948-16-6
PubChem CID7009590
IUPAC Name(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
Molecular FormulaC9H17NO4
Molecular Weight203.24
XLogP1.1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity231
SMILES
C[C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C
InChI
InChI=1S/C9H17NO4/c1-6(7(11)12)10(5)8(13)14-9(2,3)4/h6H,1-5H3,(H,11,12)/t6-/m0/s1
InChIKey
VLHQXRIIQSTJCQ-LURJTMIESA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-(((tert-butoxy)carbonyl)(methyl)amino)propanoic acid
CAS: 16948-16-6
CID: 7009590
Formula: C9H17NO4
MW: 203.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight203.24
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass203.11575802
Monoisotopic Mass203.11575802
Topological Polar Surface Area66.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity231
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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