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Fmoc-N-Me-Val-OH

CAT: 0013-GTR19202712-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202712-01Size:200 mg
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Description
This product is Fmoc-N-methylvaline, a protected amino acid derivative featuring an N-terminal 9-fluorenylmethoxycarbonyl (Fmoc) group and an N-methylated valine residue. It is primarily used in solid-phase peptide synthesis (SPPS) to incorporate N-methyl amino acids, which can enhance peptide metabolic stability and membrane permeability for in vitro and in vivo pharmacological studies.
CAS Number
84000-11-3
Field of Research
Metabolism Research
Smiles
CC (C) [C@@H] (N (C) C (=O) OCC1c2ccccc2-c2ccccc12) C (O) =O
Molecular Formula
C21H23NO4
Molecular Weight
353.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-methylbutanoic acid
CAS Number84000-11-3
PubChem CID978328
IUPAC Name(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-3-methylbutanoic acid
Molecular FormulaC21H23NO4
Molecular Weight353.4
XLogP4.2
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity498
SMILES
CC(C)[C@@H](C(=O)O)N(C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C21H23NO4/c1-13(2)19(20(23)24)22(3)21(25)26-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,13,18-19H,12H2,1-3H3,(H,23,24)/t19-/m0/s1
InChIKey
YCXXXPZNQXXRIG-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-methylbutanoic acid
CAS: 84000-11-3
CID: 978328
Formula: C21H23NO4
MW: 353.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.4
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass353.16270821
Monoisotopic Mass353.16270821
Topological Polar Surface Area66.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity498
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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