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589-41-3

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589-41-3 Structure

589-41-3 Structure
IdentificationMore
[Name]

N-Hydroxyurethane
[CAS]

589-41-3
[Synonyms]

ETHYL HYDROXYCARBAMATE
ETHYL N-HYDROXYCARBAMATE
HYDROXYCARBAMIC ACID ETHYL ESTER
N-HYDROXYURETHAN
N-HYDROXYURETHANE
Ethylester kyseliny N-hydroxykarbaminove
ethylesterkyselinyn-hydroxykarbaminove
hydroxy-carbamicaciethylester
Hydroxyurethane
N-Carbethoxyhydroxylamine
NHU
N-Hydroxy ethyl carbamate
n-hydroxyethylcarbamate
NSC-71045
NSC-83629
SQ 16819
N-HYDROXYURETHAN 94+%
Ethyl hydroxycarbamate 97%
HYDROXYURETHAN
N-Hydroxycarbamic acid ethyl
[EINECS(EC#)]

209-648-0
[Molecular Formula]

C3H7NO3
[MDL Number]

MFCD00002108
[Molecular Weight]

105.09
[MOL File]

589-41-3.mol
Chemical PropertiesBack Directory
[Boiling point ]

113-116 °C3 mm Hg(lit.)
[density ]

1.3895 (rough estimate)
[refractive index ]

n20/D 1.445(lit.)
[Fp ]

>230 °F
[storage temp. ]

−20°C
[solubility ]

Diethyl Ether, Dimethyl Sulfoxide, Water
[form ]

Oil
[pka]

9.30±0.23(Predicted)
[color ]

Yellow
[BRN ]

1747529
[InChI]

1S/C3H7NO3/c1-2-7-3(5)4-6/h6H,2H2,1H3,(H,4,5)
[InChIKey]

VGEWEGHHYWGXGG-UHFFFAOYSA-N
[SMILES]

CCOC(=O)NO
[CAS DataBase Reference]

589-41-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Carbamic acid, hydroxy-, ethyl ester(589-41-3)
Safety DataBack Directory
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

2
[RTECS ]

FB1750000
[HS Code ]

2928009090
[Storage Class]

10 - Combustible liquids
[Toxicity]

LD50 intraperitoneal in rat: 800mg/kg
Hazard InformationBack Directory
[Chemical Properties]

Yellow Oil
[Uses]

Reactant involved in:
  • Synthesis of molecules used for intermolecular Sharpless aminohydroxylation reactions
  • Intermolecular ortho-C-H amidation of anilides
  • Cinchona alkaloid-catalyzed asymmetric cycloaddition
  • Allylic arylation
[Uses]

Hydroxyurethane is a metabolite of carcinogenic Urethane (U825300).
[Uses]

Metabolite of carcinogenic Urethane (U825300).
[Biochem/physiol Actions]

N-Hydroxyurethane causes the chromosomal fragmentation at millimolar concentrations and cell toxicity in cultured normal human leukocytes.
Spectrum DetailBack Directory
[Spectrum Detail]

N-Hydroxyurethane(589-41-3)MS
N-Hydroxyurethane(589-41-3)1HNMR
N-Hydroxyurethane(589-41-3)13CNMR
N-Hydroxyurethane(589-41-3)IR1
N-Hydroxyurethane(589-41-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

589-41-3(sigmaaldrich)
[TCI AMERICA]

N-Hydroxyurethane,>85.0%(GC)(N)(589-41-3)
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