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N- (Phenylmethoxy) urea

CAT: 0127-OR50831-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR50831-01Size:250 mg
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CAS Number
2048-50-2
MDL Number
MFCD00047867
Purity
=95%
Smiles
NC(=O)NOCc1ccccc1

Chemical Information

Benzyloxyurea
CAS Number2048-50-2
PubChem CID231398
IUPAC Namephenylmethoxyurea
Molecular FormulaC8H10N2O2
Molecular Weight166.18
XLogP0.5
Topological Polar Surface Area64.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity144
SMILES
C1=CC=C(C=C1)CONC(=O)N
InChI
InChI=1S/C8H10N2O2/c9-8(11)10-12-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11)
InChIKey
IXRIVZOKBPYSPK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyloxyurea
CAS: 2048-50-2
CID: 231398
Formula: C8H10N2O2
MW: 166.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight166.18
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass166.074227566
Monoisotopic Mass166.074227566
Topological Polar Surface Area64.4 Ų
Heavy Atom Count12
Formal Charge0
Complexity144
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes