Home Halogens (5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol

(5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol

CAS No.:
946426-89-7
Catalog Number:
AG0069EK
Molecular Formula:
C13H11Cl2NO2
Molecular Weight:
284.1379
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Product Description
Catalog Number:
AG0069EK
Chemical Name:
(5-Cyclopropyl-3-(2,6-dichlorophenyl)isoxazol-4-yl)methanol
CAS Number:
946426-89-7
Molecular Formula:
C13H11Cl2NO2
Molecular Weight:
284.1379
MDL Number:
MFCD11046189
IUPAC Name:
[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methanol
InChI:
InChI=1S/C13H11Cl2NO2/c14-9-2-1-3-10(15)11(9)12-8(6-17)13(18-16-12)7-4-5-7/h1-3,7,17H,4-6H2
InChI Key:
KRGFOUGVZFEEBW-UHFFFAOYSA-N
SMILES:
OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.017g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.136g/mol
Monoisotopic Mass:
283.017g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties