Amino-PEG6-acid

C15H31NO8CAS 905954-28-1353.41 g/mol

Open in Covalent MOL file
OOOOOONH2OHO
Carboxylic acidEtherPrimary amine

Properties

Molecular formula
C15H31NO8
Molar mass
353.41 g/mol
Exact mass
353.2050 Da
logP
-0.48Crippen estimate
Polar surface area
118.7 Ų
H-bond donors / acceptors
2 / 8
Rotatable bonds
20

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
905954-28-1
SMILES
C(COCCOCCOCCOCCOCCOCCN)C(=O)O
InChIKey
PVRGRRPCHFTMMD-UHFFFAOYSA-N
InChI
InChI=1S/C15H31NO8/c16-2-4-20-6-8-22-10-12-24-14-13-23-11-9-21-7-5-19-3-1-15(17)18/h1-14,16H2,(H,17,18)

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Names and synonyms

1 names
  • Alpha-amine-omega-propionic acid hexaethylene glycol

Work with Amino-PEG6-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

27-Amino-4,7,10,13,16,19,22,25-octaoxaheptacosanoic acid756526-04-2100 % similar Alpha-amine-omega-propionic acid triethylene glycol784105-33-5100 % similar (2-(2-Aminoethoxy)ethoxy)acetic acid134978-97-571 % similar Amino-peg4-ch2co2H195071-49-971 % similar 2-(2-(2-Aminoethoxy)ethoxy)acetic acid hydrochloride134979-01-465 % similar 2,5,8,11-Tetraoxatetradecan-14-oic acid67319-28-262 % similar β-Alanine107-95-958 % similar 17-Amino-10-oxo-3,6,12,15-tetraoxa-9-azaheptadecanoic acid1143516-05-554 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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