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Cyproconazole

CAT: 1299-RG-A260985-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A260985-02Size:25 mg
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CAS Number
94361-06-5
Synonyms
Cyproconazole
Molecular Formula
C15H18ClN3O
Molecular Weight
291.78
Target Alternative Name
Cyproconazole
Product Name Synonym
Cyproconazole

Chemical Information

Cyproconazole

2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol is a tertiary alcohol that is butan-2-ol substituted by a 4-chlorophenyl group at position 2, a cyclopropyl group at position 3 and a 1H-1,2,4-triazol-1-yl group at position 1. It is a tertiary alcohol, a member of triazoles, a member of cyclopropanes and a member of monochlorobenzenes.

CAS Number94361-06-5
PubChem CID86132
IUPAC Name2-(4-chlorophenyl)-3-cyclopropyl-1-(1,2,4-triazol-1-yl)butan-2-ol
Molecular FormulaC15H18ClN3O
Molecular Weight291.77
XLogP2.9
Topological Polar Surface Area50.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity331
SMILES
CC(C1CC1)C(CN2C=NC=N2)(C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3
InChIKey
UFNOUKDBUJZYDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyproconazole
CAS: 94361-06-5
CID: 86132
Formula: C15H18ClN3O
MW: 291.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight291.77
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass291.1138399
Monoisotopic Mass291.1138399
Topological Polar Surface Area50.9 Ų
Heavy Atom Count20
Formal Charge0
Complexity331
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP18099Cyproconazole
HY-A0277R-01Cyproconazole (Standard)
AR-C08801-01Cyproconazole-d4
TRC-H594050-100MG3-Hydroxy Cyproconazole
AR-C08802-01Cyproconazole Impurity 1
S-48631000ug/mL Cyproconazole in MeOH - 1ML
LCS-48631000 ug/mL Cyproconazole in HPLC Grade Acetonitrile - 1ML

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