4-Ethoxyphenylurea

CAT: 0127-OR22579-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR22579-01Size:1 g

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CAS Number

150-69-6

Synonyms

4-Ureidophenetole, 4- (Carbamoylamino) phenetole

MDL Number

MFCD00025431

Purity

=95%

Smiles

CCOc1ccc(NC(=O)N)cc1

Chemical Information

Dulcin

Dulcin is a member of ureas.

CAS Number	150-69-6
PubChem CID	9013
IUPAC Name	(4-ethoxyphenyl)urea
Molecular Formula	C9H12N2O2
Molecular Weight	180.20
XLogP	1
Topological Polar Surface Area	64.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	165

SMILES

CCOC1=CC=C(C=C1)NC(=O)N

InChI

InChI=1S/C9H12N2O2/c1-2-13-8-5-3-7(4-6-8)11-9(10)12/h3-6H,2H2,1H3,(H3,10,11,12)

InChIKey

GGLIEWRLXDLBBF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 150-69-6

CID: 9013

Formula: C9H12N2O2

MW: 180.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	180.20
XLogP3	1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	180.089877630
Monoisotopic Mass	180.089877630
Topological Polar Surface Area	64.4 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	165
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
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PC4810-01	4,4,4,4',4',4'-Hexafluoro-DL-valine
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