1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane

C₁₄H₃₂N₄CAS 41203-22-9256.44 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₃₂N₄
Molar mass: 256.44 g/mol
Exact mass: 256.2627 Da
logP: 0.51Crippen estimate
Polar surface area: 13.0 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.7% of notifiers

Aggregated from 44 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

41203-22-9

SMILES

CN1CCCN(CCN(CCCN(CC1)C)C)C

InChIKey

HRFJEOWVAGSJNW-UHFFFAOYSA-N

InChI

InChI=1S/C14H32N4/c1-15-7-5-8-17(3)13-14-18(4)10-6-9-16(2)12-11-15/h5-14H2,1-4H3

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Names and synonyms

1 names

1,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-tetramethyl-

Work with 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane

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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