1,1-Dimethylethyl N,N′-bis(1-methylethyl)carbamimidate

C₁₁H₂₄N₂OCAS 71432-55-8200.33 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₂₄N₂O
Molar mass: 200.33 g/mol
Exact mass: 200.1889 Da
Boiling point: 86 °C (at 0.24 Torr)
logP: 2.56Crippen estimate
Polar surface area: 33.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

71432-55-8

SMILES

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

InChIKey

FESDUDPSRMWIDL-UHFFFAOYSA-N

InChI

InChI=1S/C11H24N2O/c1-8(2)12-10(13-9(3)4)14-11(5,6)7/h8-9H,1-7H3,(H,12,13)

Weigh it out

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

Names and synonyms

6 names

Carbamimidic acid, N,N′-bis(1-methylethyl)-, 1,1-dimethylethyl ester
O-tert-Butyl-N,N′-diisopropylisourea
N,N′-Diisopropyl-O-tert-butylisourea
2-tert-Butyl-1,3-diisopropylpseudourea
2-tert-Butyl-1,3-diisopropylisourea
tert-Butyl N,N′-dipropan-2-ylcarbamimidate

Work with 1,1-Dimethylethyl N,N′-bis(1-methylethyl)carbamimidate

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

N,N′-Bis(1-methylethyl)thiourea2986-17-642 % similar 1,1-Dimethylethyl 2-(1-methylethyl)hydrazinecarboxylate16689-35-341 % similar tert-Butyl N-((2R)-1-hydroxypropan-2-yl)carbamate106391-86-035 % similar 1,1-Dimethylethyl N-[(1S)-2-hydroxy-1-methylethyl]carbamate79069-13-935 % similar Boc-L-alaninal79069-50-435 % similar (R)-3-((tert-Butoxycarbonyl)amino)butanoic acid159991-23-832 % similar N-Me-ala-otbu hcl103614-40-032 % similar tert-Butyl N-[(2S)-1-aminopropan-2-yl]carbamate146552-71-832 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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