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L-tert-Leucine

CAT: 0862-GM4241-1gSize: 1 gDry Ice: NoHazardous: No
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CAT#:0862-GM4241-1gSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
20859-02-3
EC Number
424-750-7
MDL Number
MFCD00064218
Molecular Formula
C6H13NO2
Molecular Weight
131.18
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

L-tert-Leucine
CAS Number20859-02-3
PubChem CID164608
IUPAC Name(2S)-2-amino-3,3-dimethylbutanoic acid
Molecular FormulaC6H13NO2
Molecular Weight131.17
XLogP-1.8
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity115
SMILES
CC(C)(C)[C@@H](C(=O)O)N
InChI
InChI=1S/C6H13NO2/c1-6(2,3)4(7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t4-/m1/s1
InChIKey
NPDBDJFLKKQMCM-SCSAIBSYSA-N
Chemical Structure
2D Structure
2D structure of L-tert-Leucine
CAS: 20859-02-3
CID: 164608
Formula: C6H13NO2
MW: 131.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.17
XLogP3-1.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass131.094628657
Monoisotopic Mass131.094628657
Topological Polar Surface Area63.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity115
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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