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D-Leucine-1-13C

CAT: 0572-TRC-L524230-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-L524230-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
82152-60-1
Hazard Statement
No Data Available
Smiles
CC(C)C[C@@H](N)[13C](=O)O
Molecular Formula
13C C5 H13 N O2
Molecular Weight
132.166
InChI
InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1/i6+1
Additionnal Information
IUPAC name: (2R)-2-amino-4-methyl(113C)pentanoic acid
Shipping Conditions
Room Temperature

Chemical Information

D-Leucine-1-13C
CAS Number82152-60-1
PubChem CID16057700
IUPAC Name(2R)-2-amino-4-methyl(113C)pentanoic acid
Molecular FormulaC6H13NO2
Molecular Weight132.17
XLogP-1.5
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity101
SMILES
CC(C)C[C@H]([13C](=O)O)N
InChI
InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1/i6+1
InChIKey
ROHFNLRQFUQHCH-BZNBBFKTSA-N
Chemical Structure
2D Structure
2D structure of D-Leucine-1-13C
CAS: 82152-60-1
CID: 16057700
Formula: C6H13NO2
MW: 132.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight132.17
XLogP3-1.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass132.097983493
Monoisotopic Mass132.097983493
Topological Polar Surface Area63.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity101
Isotope Atom Count1
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes