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N-Methyl-D-alanine

CAT: 0572-TRC-M285108-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M285108-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
29475-64-7
Hazard Statement
No Data Available
Smiles
CN[C@H](C)C(O)=O
Molecular Formula
C4H9NO2
Molecular Weight
103.12
InChI
InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m1/s1
Additionnal Information
IUPAC name: Methyl-D-alanine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(2R)-2-(methylamino)propanoic acid
CAS Number29475-64-7
PubChem CID92973
IUPAC Name(2R)-2-(methylamino)propanoic acid
Molecular FormulaC4H9NO2
Molecular Weight103.12
XLogP-2.5
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity72
SMILES
C[C@H](C(=O)O)NC
InChI
InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m1/s1
InChIKey
GDFAOVXKHJXLEI-GSVOUGTGSA-N
Chemical Structure
2D Structure
2D structure of (2R)-2-(methylamino)propanoic acid
CAS: 29475-64-7
CID: 92973
Formula: C4H9NO2
MW: 103.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight103.12
XLogP3-2.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass103.063328530
Monoisotopic Mass103.063328530
Topological Polar Surface Area49.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity72.1
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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