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Fmoc-NH-PEG9-CH2CH2COOH

CAT: 0607-BA2553-1000Size: 1 gDry Ice: NoHazardous: No
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CAT#:0607-BA2553-1000Size:1 g
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CAS Number
1191064-81-9
Form
A liquid
Molecular Formula
C36H53NO13
Molecular Weight
707.80
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Fmoc-N-amido-PEG9-acid
CAS Number1191064-81-9
PubChem CID91757822
IUPAC Name3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC36H53NO13
Molecular Weight707.8
XLogP1.2
Topological Polar Surface Area159
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count33
Heavy Atom Count50
Formal Charge0
Complexity831
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C36H53NO13/c38-35(39)9-11-41-13-15-43-17-19-45-21-23-47-25-27-49-28-26-48-24-22-46-20-18-44-16-14-42-12-10-37-36(40)50-29-34-32-7-3-1-5-30(32)31-6-2-4-8-33(31)34/h1-8,34H,9-29H2,(H,37,40)(H,38,39)
InChIKey
NEESTRVILHNOJT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-N-amido-PEG9-acid
CAS: 1191064-81-9
CID: 91757822
Formula: C36H53NO13
MW: 707.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight707.8
XLogP31.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count33
Exact Mass707.35169075
Monoisotopic Mass707.35169075
Topological Polar Surface Area159 Ų
Heavy Atom Count50
Formal Charge0
Complexity831
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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