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Fmoc-Gln (Trt) -Gln (Trt) -Oh

CAT: 1299-RM-F131572-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F131572-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2244048-22-2
Synonyms
N2- (N2- (((9H-fluoren-9-yl) methoxy) carbonyl) -N5-trityl-L-glutaminyl) -N5-trityl-L-glutamine
Molecular Formula
C63H56N4O7
Molecular Weight
981.16
Target Alternative Name
Fmoc
Product Name Synonym
N2- (N2- (((9H-fluoren-9-yl) methoxy) carbonyl) -N5-trityl-L-glutaminyl) -N5-trityl-L-glutamine

Chemical Information

Fmoc-Gln(Trt)-Gln(Trt)-OH
CAS Number2244048-22-2
PubChem CID155291079
IUPAC Name(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxo-5-(tritylamino)pentanoyl]amino]-5-oxo-5-(tritylamino)pentanoic acid
Molecular FormulaC63H56N4O7
Molecular Weight981.1
XLogP10.6
Topological Polar Surface Area163
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count21
Heavy Atom Count74
Formal Charge0
Complexity1690
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(=O)CC[C@@H](C(=O)N[C@@H](CCC(=O)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)O)NC(=O)OCC7C8=CC=CC=C8C9=CC=CC=C79
InChI
InChI=1S/C63H56N4O7/c68-57(66-62(44-23-7-1-8-24-44,45-25-9-2-10-26-45)46-27-11-3-12-28-46)41-39-55(65-61(73)74-43-54-52-37-21-19-35-50(52)51-36-20-22-38-53(51)54)59(70)64-56(60(71)72)40-42-58(69)67-63(47-29-13-4-14-30-47,48-31-15-5-16-32-48)49-33-17-6-18-34-49/h1-38,54-56H,39-43H2,(H,64,70)(H,65,73)(H,66,68)(H,67,69)(H,71,72)/t55-,56-/m0/s1
InChIKey
LVTYYNONHHVBGB-ATMVKLMESA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Gln(Trt)-Gln(Trt)-OH
CAS: 2244048-22-2
CID: 155291079
Formula: C63H56N4O7
MW: 981.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight981.1
XLogP310.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count21
Exact Mass980.41490014
Monoisotopic Mass980.41490014
Topological Polar Surface Area163 Ų
Heavy Atom Count74
Formal Charge0
Complexity1690
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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