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Urea,N-(2-hydroxyethyl)-(CAS No. 2078-71-9)

Urea,N-(2-hydroxyethyl)- C3H8N2O2 (cas 2078-71-9) Molecular Structure

2078-71-9 Structure

Identification and Related Records

【Name】
Urea,N-(2-hydroxyethyl)-
【CAS Registry number】
2078-71-9
【Synonyms】
Urea,(2-hydroxyethyl)- (6CI,7CI,8CI,9CI)
(2-Hydroxyethyl)urea
(b-Hydroxyethyl)urea
1-(2-Hydroxyethyl)urea
Hydrovance
Monoethanolurea
Monoethylolurea
N-(2-Hydroxyethyl)urea
N-(b-Hydroxyethyl)urea
NSC 1127
【Molecular Formula】
C3H8N2O2 (Products with the same molecular formula)
【Molecular Weight】
104.1079
【Inchi】
InChI=1S/C3H8N2O2/c4-3(7)5-1-2-6/h6H,1-2H2,(H3,4,5,7)
【InChIKey】
CLAHOZSYMRNIPY-UHFFFAOYSA-N
【Canonical SMILES】
C(CO)NC(=O)N
【MOL File】
2078-71-9.mol

Chemical and Physical Properties

【Appearance】
White, fine, free-flowing powder
【Density】
1.222 g/cm3
【Melting Point】
164-169 °C
【Boiling Point】
254.3 °C at 760 mmHg
【Flash Point】
107.6 °C
【Computed Properties】
Molecular Weight:104.10782 [g/mol]
Molecular Formula:C3H8N2O2
XLogP3-AA:-1.7
H-Bond Donor:3
H-Bond Acceptor:2
Rotatable Bond Count:2
Tautomer Count:3
Exact Mass:104.058578
MonoIsotopic Mass:104.058578
Topological Polar Surface Area:75.4
Heavy Atom Count:7
Formal Charge:0
Complexity:64
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.4
CID Conformer Count:11

Safety and Handling

【Risk Statements】
R36/37/38
【Safety Statements 】
26-36/37/39

Supplier Location

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Raw materials
Preparation Products

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