chempirical

N,N-Dimethylurea

C3H8N2OCAS 598-94-788.11 g/mol

Open in Covalent MOL file
NNH2O

Properties

Molecular formula
C3H8N2O
Molar mass
88.11 g/mol
Exact mass
88.0637 Da
Density
1.26 g/mL
Melting point
182 °C
logP
0.04Crippen estimate
Polar surface area
47.3 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 49 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
598-94-7
SMILES
CN(C)C(=N)O
InChIKey
YBBLOADPFWKNGS-UHFFFAOYSA-N
InChI
InChI=1S/C3H8N2O/c1-5(2)3(4)6/h1-2H3,(H2,4,6)

Weigh it out

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

Names and synonyms

6 names
  • Urea, N,N-dimethyl-
  • Urea, 1,1-dimethyl-
  • 1,1-Dimethylurea
  • Asym-Dimethylurea
  • NSC 33603
  • N,N-Dimethylcarbamide

Reactions

Work with N,N-Dimethylurea

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-Nitroso-N-methylurea684-93-544 % similar N,N-Diethylurea634-95-743 % similar 1,1,3,3-Tetramethylguanidine80-70-642 % similar N,N-Dimethylselenourea5117-16-836 % similar 2,5-Dihydro-2,5-dioxo-1H-pyrrole-1-carboxamide3345-50-435 % similar ENU759-73-934 % similar Tetrakis(dimethylamino)ethylene996-70-333 % similar 2-Aminopropanediamide62009-47-630 % similar

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

Same formula

Propiohydrazide5818-15-5 Ethylurea625-52-5 Ethylurea9009-54-5 Dimethylurea96-31-1

Elsewhere

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