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(Cyclohexanecarbonyl) -L-leucine 250mg

CAT: 0628-A23797-250Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0628-A23797-250Size:250 mg
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CAS Number
157116-68-2

Chemical Information

(Cyclohexanecarbonyl)-L-leucine
CAS Number157116-68-2
PubChem CID9992929
IUPAC Name(2S)-2-(cyclohexanecarbonylamino)-4-methylpentanoic acid
Molecular FormulaC13H23NO3
Molecular Weight241.33
XLogP2.9
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity270
SMILES
CC(C)C[C@@H](C(=O)O)NC(=O)C1CCCCC1
InChI
InChI=1S/C13H23NO3/c1-9(2)8-11(13(16)17)14-12(15)10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3,(H,14,15)(H,16,17)/t11-/m0/s1
InChIKey
MJOSQGRPLTUAHR-NSHDSACASA-N
Chemical Structure
2D Structure
2D structure of (Cyclohexanecarbonyl)-L-leucine
CAS: 157116-68-2
CID: 9992929
Formula: C13H23NO3
MW: 241.33
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight241.33
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass241.16779360
Monoisotopic Mass241.16779360
Topological Polar Surface Area66.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity270
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