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Vinclozolin

CAT: 1596-AR-V06705-04Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-V06705-04Size:100 Units
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CAS Number
50471-44-8
Molecular Formula
C12H9Cl2NO3
Molecular Weight
286.11
API Name
Vinclozolin

Chemical Information

Vinclozolin

Vinclozolin can cause cancer according to an independent committee of scientific and health experts. It can cause developmental toxicity according to The Environmental Protection Agency (EPA).

CAS Number50471-44-8
PubChem CID39676
IUPAC Name3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-1,3-oxazolidine-2,4-dione
Molecular FormulaC12H9Cl2NO3
Molecular Weight286.11
XLogP3.1
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity391
SMILES
CC1(C(=O)N(C(=O)O1)C2=CC(=CC(=C2)Cl)Cl)C=C
InChI
InChI=1S/C12H9Cl2NO3/c1-3-12(2)10(16)15(11(17)18-12)9-5-7(13)4-8(14)6-9/h3-6H,1H2,2H3
InChIKey
FSCWZHGZWWDELK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vinclozolin
CAS: 50471-44-8
CID: 39676
Formula: C12H9Cl2NO3
MW: 286.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.11
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass284.9959485
Monoisotopic Mass284.9959485
Topological Polar Surface Area46.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity391
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-V314050-100MGVinclozolin
TRC-V314055-100MGVinclozolin M2
S-3796-ISOVinclozolin - EACH
TRC-V314053-10MGVinclozolin-13C3,D3
sc-475650AVinclozolin-13C3, D3
TRC-V314052-100MGVinclozolin(5-Methyl-13C, Oxazolidinone-2,4-13C2)
P01340AVinclozolin [CAS:50471-44-8] 100mg/l in Acetone

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