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L-Threonine-15N

CAT: 0572-TRC-T405563-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T405563-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
80681-09-0
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
[15NH2]C(C(O)=O)[C@H](O)C
Molecular Formula
C4H9¹⁵NO3
Molecular Weight
120.11
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

L-Threonine-15N
CAS Number80681-09-0
PubChem CID16217581
IUPAC Name(2S,3R)-2-(15N)azanyl-3-hydroxybutanoic acid
Molecular FormulaC4H9NO3
Molecular Weight120.11
XLogP-2.9
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity93
SMILES
C[C@H]([C@@H](C(=O)O)[15NH2])O
InChI
InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1/i5+1
InChIKey
AYFVYJQAPQTCCC-SZEKAKMSSA-N
Chemical Structure
2D Structure
2D structure of L-Threonine-15N
CAS: 80681-09-0
CID: 16217581
Formula: C4H9NO3
MW: 120.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight120.11
XLogP3-2.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass120.05527804
Monoisotopic Mass120.05527804
Topological Polar Surface Area83.6 Ų
Heavy Atom Count8
Formal Charge0
Complexity93.3
Isotope Atom Count1
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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