Di-tert-butyl azodicarboxylate

C₁₀H₁₈N₂O₄CAS 870-50-8230.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₈N₂O₄
Molar mass: 230.26 g/mol
Exact mass: 230.1267 Da
Melting point: 85–87 °C
logP: 3.31Crippen estimate
Polar surface area: 77.3 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation89.3% of notifiers
H319 Causes serious eye irritation89.3% of notifiers
H335 May cause respiratory irritation87.5% of notifiers

Aggregated from 56 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

870-50-8

SMILES

CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)C

InChIKey

QKSQWQOAUQFORH-UHFFFAOYSA-N

InChI

InChI=1S/C10H18N2O4/c1-9(2,3)15-7(13)11-12-8(14)16-10(4,5)6/h1-6H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names

1,2-Diazenedicarboxylic acid, 1,2-bis(1,1-dimethylethyl) ester
Formic acid, azodi-, di-tert-butyl ester
Diazenedicarboxylic acid, bis(1,1-dimethylethyl) ester
Di-tert-butyl azodiformate
Azodicarboxylic acid di-tert-butyl ester
Di-tert-butyl diazodicarboxylate
DBAD
NSC 109889
Bis(1,1-dimethylethyl)azodicarboxylate

Reactions

t-BUTYL AZODIFORMATE (Formic acid, azodi-, di-tert-butyl ester)product

Work with Di-tert-butyl azodicarboxylate

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

Boc-guanidine219511-71-458 % similar tert-Butoxycarbonyl azide1070-19-556 % similar Di-tert-butyl-iminodicarboxylate51779-32-956 % similar Di-tert-butyl dicarbonate24424-99-546 % similar tert-Butyl acetate540-88-546 % similar N-Boc-imino-(triphenyl)phosphorane68014-21-145 % similar tert-Butyl trimethylacetate16474-43-444 % similar 1,3-Bis(1,1-dimethylethyl) propanedioate541-16-244 % similar

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

Same formula

1-Boc-2-piperazinecarboxylic acid1214196-85-6 4-[(tert-Butoxy)carbonyl]piperazine-2-carboxylic acid128019-59-0 1,1'-Dimethyl 2,2'-(1,2-diazenediyl)bis(2-methylpropanoate)2589-57-3 (R)-4-Boc-piperazine-3-carboxylic acid278788-60-6 4-[4-(2-Hydroxy-ethyl)-piperazin-1-yl]-4-oxo-butyric acid717904-43-3 (S)-4-N-Boc-piperazine-2-carboxylic acid848482-93-9

Elsewhere

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