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N-allyl-N'-(2-hydroxy-1,1-dimethylethyl)urea

HCID 59141069
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=CCNC(=O)NC(C)(C)CO
InChIKey
FIMVNKFNIOWIAK-UHFFFAOYSA-N
Molecular formula
C8H16N2O2
Average molar mass
172.22 g/mol

Names & identifiers

Preferred name
N-allyl-N'-(2-hydroxy-1,1-dimethylethyl)urea
IUPAC
1-(1-hydroxy-2-methylpropan-2-yl)-3-prop-2-enylurea

Names & synonyms

SCHEMBL589028FIMVNKFNIOWIAK-UHFFFAOYSA-NN-allyl-N'-(2-hydroxy-1,1-dimethylethyl)urea

Database identifiers

PubChem CID
59141069

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
61.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
166

Related reactions

3 records
New reaction record
HRID 122551 reaction equation
HRID 122551As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1009871 reaction equation
HRID 1009871As productuspto-grants-2011_07
HRID 1009887 reaction equation
HRID 1009887As reactantuspto-grants-2011_07

Compound notes

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