1,1-Dimethylethyl 2-(1-methylethyl)hydrazinecarboxylate

C₈H₁₈N₂O₂CAS 16689-35-3174.24 g/mol

Open in Covalent MOL file

Hydrazone Secondary amine

Properties

Molecular formula: C₈H₁₈N₂O₂
Molar mass: 174.24 g/mol
Exact mass: 174.1368 Da
Melting point: 47–51 °C
logP: 1.63Crippen estimate
Polar surface area: 53.9 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Identifiers

CAS number

16689-35-3

SMILES

CC(C)NN=C(O)OC(C)(C)C

InChIKey

PUAKAEDMCXRDPR-UHFFFAOYSA-N

InChI

InChI=1S/C8H18N2O2/c1-6(2)9-10-7(11)12-8(3,4)5/h6,9H,1-5H3,(H,10,11)

Weigh it out

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

Names and synonyms

6 names

Hydrazinecarboxylic acid, 2-(1-methylethyl)-, 1,1-dimethylethyl ester
Carbazic acid, 3-isopropyl-, tert-butyl ester
tert-Butyl 2-isopropylhydrazinecarboxylate
2-Isopropylhydrazinecarboxylic acid tert-butyl ester
1-Boc-2-isopropylhydrazine
N'-(Propan-2-yl)(tert-butoxy)carbohydrazide

Work with 1,1-Dimethylethyl 2-(1-methylethyl)hydrazinecarboxylate

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

1,2-Bis(1,1-dimethylethyl) 1,2-hydrazinedicarboxylate16466-61-852 % similar tert-Butyl N-((2R)-1-hydroxypropan-2-yl)carbamate106391-86-050 % similar 1,1-Dimethylethyl N-[(1S)-2-hydroxy-1-methylethyl]carbamate79069-13-950 % similar tert-Butyl N-hydroxycarbamate36016-38-348 % similar tert-Butyl carbazate870-46-247 % similar (R)-3-((tert-Butoxycarbonyl)amino)butanoic acid159991-23-845 % similar tert-Butoxycarbonylalanine15761-38-345 % similar 4-(N-Boc-amino)piperidine73874-95-045 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Boc-N-methylethylenediamine121492-06-6 N-(tert-Butoxycarbonyl)-N'-methylethylenediamine122734-32-1 1,4-Piperazinediethanol122-96-3 1-[2-(2-Hydroxyethoxy)ethyl]piperazine13349-82-1 tert-Butyl N-[(2S)-1-aminopropan-2-yl]carbamate146552-71-8 tert-Butyl (3-aminopropyl)carbamate75178-96-0

Elsewhere

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