Metobromuron

CAT: 0024-sc-250405Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-250405Size:100 mg

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CAS Number

3060-89-7

Chemical Information

Metobromuron

Metobromuron is a member of ureas.

CAS Number	3060-89-7
PubChem CID	18290
IUPAC Name	3-(4-bromophenyl)-1-methoxy-1-methylurea
Molecular Formula	C9H11BrN2O2
Molecular Weight	259.10
XLogP	2.4
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	193

SMILES

CN(C(=O)NC1=CC=C(C=C1)Br)OC

InChI

InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)

InChIKey

WLFDQEVORAMCIM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3060-89-7

CID: 18290

Formula: C9H11BrN2O2

MW: 259.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	259.10
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	258.00039
Monoisotopic Mass	258.00039
Topological Polar Surface Area	41.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	193
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
TRC-M371883-500MG	Metobromuron
S-2574	Metobromuron - 1ML
HY-154817R	Metobromuron (Standard)
M371884	Metobromuron-d6 (methoxy-d3; N-methyl-d3)