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Fmoc-Asp-OMe 100g

CAT: 0628-A23356-100000Size: 100000 mgDry Ice: NoHazardous: No
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CAT#:0628-A23356-100000Size:100000 mg
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CAS Number
145038-52-4

Chemical Information

(S)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-methoxy-4-oxobutanoic acid
CAS Number145038-52-4
PubChem CID40423784
IUPAC Name(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methoxy-4-oxobutanoic acid
Molecular FormulaC20H19NO6
Molecular Weight369.4
XLogP2.5
Topological Polar Surface Area102
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count27
Formal Charge0
Complexity543
SMILES
COC(=O)[C@H](CC(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C20H19NO6/c1-26-19(24)17(10-18(22)23)21-20(25)27-11-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,16-17H,10-11H2,1H3,(H,21,25)(H,22,23)/t17-/m0/s1
InChIKey
UEUZUMRMWJUEMK-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of (S)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-methoxy-4-oxobutanoic acid
CAS: 145038-52-4
CID: 40423784
Formula: C20H19NO6
MW: 369.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight369.4
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass369.12123733
Monoisotopic Mass369.12123733
Topological Polar Surface Area102 Ų
Heavy Atom Count27
Formal Charge0
Complexity543
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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