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NN'-Bis(2-hydroxyethyl)urea

CAT: 0572-TRC-N756610-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N756610-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
15438-70-7
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
OCCNC(=O)NCCO
Molecular Formula
C5H12N2O3
Molecular Weight
148.16
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Urea, N,N'-bis(2-hydroxyethyl)-
CAS Number15438-70-7
PubChem CID84910
IUPAC Name1,3-bis(2-hydroxyethyl)urea
Molecular FormulaC5H12N2O3
Molecular Weight148.16
XLogP-2
Topological Polar Surface Area81.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity86
SMILES
C(CO)NC(=O)NCCO
InChI
InChI=1S/C5H12N2O3/c8-3-1-6-5(10)7-2-4-9/h8-9H,1-4H2,(H2,6,7,10)
InChIKey
KSYGJAFGQWTAFW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Urea, N,N'-bis(2-hydroxyethyl)-
CAS: 15438-70-7
CID: 84910
Formula: C5H12N2O3
MW: 148.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight148.16
XLogP3-2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass148.08479225
Monoisotopic Mass148.08479225
Topological Polar Surface Area81.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity86.9
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

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