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885024-86-2 | Urea, [2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS No: 885024-86-2 Catalog No: AG004952 MDL No:
Product Description
Catalog Number:
AG004952
Chemical Name:
Urea, [2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS Number:
885024-86-2
Molecular Formula:
C4H10N2O3
Molecular Weight:
134.1338
IUPAC Name:
1,3-dihydroxypropan-2-ylurea
InChI:
InChI=1S/C4H10N2O3/c5-4(9)6-3(1-7)2-8/h3,7-8H,1-2H2,(H3,5,6,9)
InChI Key:
SSZYXOKKPYHGLM-UHFFFAOYSA-N
SMILES:
OCC(NC(=O)N)CO
Properties
Complexity:
91.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.069g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
134.135g/mol
Monoisotopic Mass:
134.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
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