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885024-90-8 | Urea, N-(2-hydroxyethyl)-N'-[2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS No: 885024-90-8 Catalog No: AG0049G9 MDL No:
Product Description
Catalog Number:
AG0049G9
Chemical Name:
Urea, N-(2-hydroxyethyl)-N'-[2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS Number:
885024-90-8
Molecular Formula:
C6H14N2O4
Molecular Weight:
178.1864
IUPAC Name:
1-(1,3-dihydroxypropan-2-yl)-3-(2-hydroxyethyl)urea
InChI:
InChI=1S/C6H14N2O4/c9-2-1-7-6(12)8-5(3-10)4-11/h5,9-11H,1-4H2,(H2,7,8,12)
InChI Key:
WGFQARDLDGTVKH-UHFFFAOYSA-N
SMILES:
OCCNC(=O)NC(CO)CO
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
178.188g/mol
Monoisotopic Mass:
178.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
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