Fmoc-12-amino-4,7,10-trioxadodecanoic acid

C24H29NO7CAS 867062-95-1443.50 g/mol

Open in Covalent MOL file
OONHOOOOOH
CarbamateCarboxylic acidEther

Properties

Molecular formula
C24H29NO7
Molar mass
443.50 g/mol
Exact mass
443.1944 Da
logP
3.05Crippen estimate
Polar surface area
103.3 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
14

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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
867062-95-1
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCOCCC(=O)O
InChIKey
CHIDDYZONKDHLG-UHFFFAOYSA-N
InChI
InChI=1S/C24H29NO7/c26-23(27)9-11-29-13-15-31-16-14-30-12-10-25-24(28)32-17-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-8,22H,9-17H2,(H,25,28)(H,26,27)

Weigh it out

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Work with Fmoc-12-amino-4,7,10-trioxadodecanoic 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

Fmoc-N-amido-peg24-acid2170484-59-8100 % similar Fmoc-15-amino-4,7,10,13-tetraoxapentadecanoic acid557756-85-1100 % similar Fmoc-nh-peg12-ch2ch2cooh756526-01-9100 % similar Fmoc-9-amino-4,7-dioxanonanoic acid872679-70-4100 % similar Fmoc-N-amido-peg1-acid1654740-73-498 % similar Fmoc-NH-PEG4-CH2COOH437655-95-383 % similar Fmoc-nh-8(ethylene glycol)-acetic acid868594-52-983 % similar Fmoc-B-ala-oh35737-10-180 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Fmoc-L-Glu(OtBu)-OH monohydrate204251-24-1

Elsewhere

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