Fmoc-nh-8(ethylene glycol)-acetic acid

C₃₃H₄₇NO₁₂CAS 868594-52-9649.73 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Ether

Properties

Molecular formula: C₃₃H₄₇NO₁₂
Molar mass: 649.73 g/mol
Exact mass: 649.3098 Da
logP: 2.74Crippen estimate
Polar surface area: 149.5 Å²
H-bond donors / acceptors: 2 / 11
Rotatable bonds: 28

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

868594-52-9

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)O

InChIKey

JRLUSGRARXJCNA-UHFFFAOYSA-N

InChI

InChI=1S/C33H47NO12/c35-32(36)26-45-24-23-44-22-21-43-20-19-42-18-17-41-16-15-40-14-13-39-12-11-38-10-9-34-33(37)46-25-31-29-7-3-1-5-27(29)28-6-2-4-8-30(28)31/h1-8,31H,9-26H2,(H,34,37)(H,35,36)

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Names and synonyms

1 names

Fmoc-NH-PEG8-CH2COOH

Work with Fmoc-nh-8(ethylene glycol)-acetic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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