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Fmoc-Asp-NH2

CAT: 0024-sc-228155Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-228155Size:1 g
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CAS Number
200335-40-6

Chemical Information

Fmoc-Asp-NH2
CAS Number200335-40-6
PubChem CID7015831
IUPAC Name(3S)-4-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoic acid
Molecular FormulaC19H18N2O5
Molecular Weight354.4
XLogP1.5
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity530
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C(=O)N
InChI
InChI=1S/C19H18N2O5/c20-18(24)16(9-17(22)23)21-19(25)26-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2,(H2,20,24)(H,21,25)(H,22,23)/t16-/m0/s1
InChIKey
VHRMWRHTRSQVJJ-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Asp-NH2
CAS: 200335-40-6
CID: 7015831
Formula: C19H18N2O5
MW: 354.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.4
XLogP31.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass354.12157168
Monoisotopic Mass354.12157168
Topological Polar Surface Area119 Ų
Heavy Atom Count26
Formal Charge0
Complexity530
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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