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Fmoc-D-Dap (Alloc) -OH

CAT: 0926-FF72506-01Size: 10 gDry Ice: NoHazardous: No
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CAT#:0926-FF72506-01Size:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
178924-05-5
MDL Number
MFCD01076137
Smiles
C=CCOC (=O) NC[C@H] (C (=O) O) NC (=O) OCC1C2=CC=CC=C2C3=CC=CC=C13
Molecular Formula
C22H22N2O6
Molecular Weight
410.42 g/mol
Controlled
No

Chemical Information

(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(((allyloxy)carbonyl)amino)propanoic acid
CAS Number178924-05-5
PubChem CID49853441
IUPAC Name(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(prop-2-enoxycarbonylamino)propanoic acid
Molecular FormulaC22H22N2O6
Molecular Weight410.4
XLogP3
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count30
Formal Charge0
Complexity617
SMILES
C=CCOC(=O)NC[C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C22H22N2O6/c1-2-11-29-21(27)23-12-19(20(25)26)24-22(28)30-13-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h2-10,18-19H,1,11-13H2,(H,23,27)(H,24,28)(H,25,26)/t19-/m1/s1
InChIKey
MPVGCCAXXFLGIU-LJQANCHMSA-N
Chemical Structure
2D Structure
2D structure of (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(((allyloxy)carbonyl)amino)propanoic acid
CAS: 178924-05-5
CID: 49853441
Formula: C22H22N2O6
MW: 410.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight410.4
XLogP33
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass410.14778643
Monoisotopic Mass410.14778643
Topological Polar Surface Area114 Ų
Heavy Atom Count30
Formal Charge0
Complexity617
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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