N'-(oxan-4-yl)(tert-butoxy)carbohydrazide

HCID 45092245CAS 693287-79-5

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Basic information

Standard SMILES: CC(C)(C)OC(=O)NNC1CCOCC1
InChIKey: KBMQRTAUUQMJGF-UHFFFAOYSA-N
Molecular formula: C10H20N2O3
Average molar mass: 216.28 g/mol
Monoisotopic mass: 216.1473925

Names & identifiers

Preferred name: N'-(oxan-4-yl)(tert-butoxy)carbohydrazide
IUPAC: tert-butyl N-(oxan-4-ylamino)carbamate
English name: Hydrazinecarboxylic acid, 2-(tetrahydro-2H-pyran-4-yl)-, 1,1-dimethylethyl ester
Molecular formula: C10H20N2O3
Molecular weight: 216.28

Names & synonyms

N'-(oxan-4-yl)(tert-butoxy)carbohydrazideRefChem:821178800-215-7693287-79-5tert-Butyl 2-(tetrahydro-2H-pyran-4-yl)hydrazinecarboxylate1-Boc-2-(4-tetrahydropyranyl)hydrazinetert-butyl N-(oxan-4-ylamino)carbamateMFCD11044978tert-Butyl 2-(oxan-4-yl)hydrazine-1-carboxylateHydrazinecarboxylic acid, 2-(tetrahydro-2H-pyran-4-yl)-, 1,1-dimethylethyl ester2-(tetrahydropyran-4-yl)hydrazinecarboxylic acid tert-butyl esterSCHEMBL1694399

Show more names

tert-Butyl 2-(tetrahydro-2H-pyran-4-yl)t-Butyl 2-(tetrahydro-2H-pyran-4-yl)hydrazinecarboxylate2-(Tetrahydropyran-4-yl)hydrazinecarboxylic acid tert-butyl ...N'-(Tetrahydro-pyran-4-yl)-hydrazinecarboxylic acid tert-butyl ester

DTXSID10666939KBMQRTAUUQMJGF-UHFFFAOYSA-Ntert-butyl 2-(tetrahydro-2H-pyran-4-yl)hydrazine-1-carboxylateAKOS015998753CS-W004226HG-0222DA-29711SY032796

Database identifiers

CAS: 693287-79-5
PubChem CID: 45092245
DTXSID: DTXSID10666939
EC Number: 800-215-7

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 59.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 15
Formal charge: 0
Complexity: 207

Physicochemical properties

Density: 1.07 · 1.07
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
pka: 10.42 · 10.42±0.20(Predicted)
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 280 · P280-P261
HS Code: 2917110099 · 2917110099

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H228 (25%): Flammable solid [Danger Flammable solids]

P203, P210, P240, P241, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P370+P378, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.