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Fmoc-Dap (Fmoc) -OH

CAT: 0121-4019016.0001Size: 1 gDry Ice: NoHazardous: No
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CAT#:0121-4019016.0001Size:1 g
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CAS Number
201473-90-7
Specifications
B-2265.0001
Sequence
Fmoc-Dap (Fmoc) -OH
Molecular Formula
C₃₃H₂₈N₂O₆
Molecular Weight
548.60
Shipping Conditions
Ambient Temperature
Storage Temperature
+5 ± 3 °C

Chemical Information

Fmoc-Dap(Fmoc)-OH
CAS Number201473-90-7
PubChem CID2756104
IUPAC Name(2S)-2,3-bis(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Molecular FormulaC33H28N2O6
Molecular Weight548.6
XLogP5.5
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count41
Formal Charge0
Complexity899
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC[C@@H](C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46
InChI
InChI=1S/C33H28N2O6/c36-31(37)30(35-33(39)41-19-29-26-15-7-3-11-22(26)23-12-4-8-16-27(23)29)17-34-32(38)40-18-28-24-13-5-1-9-20(24)21-10-2-6-14-25(21)28/h1-16,28-30H,17-19H2,(H,34,38)(H,35,39)(H,36,37)/t30-/m0/s1
InChIKey
CEEGOSWFFHSPHM-PMERELPUSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Dap(Fmoc)-OH
CAS: 201473-90-7
CID: 2756104
Formula: C33H28N2O6
MW: 548.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight548.6
XLogP35.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass548.19473662
Monoisotopic Mass548.19473662
Topological Polar Surface Area114 Ų
Heavy Atom Count41
Formal Charge0
Complexity899
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