Name: Name:Isoxazole, 4-(chloromethyl)-5-cyclopropyl-3-(2,6-dichlorophenyl)-
Brand: Angene
SKU: AG000TA7
Rating: 90 (10 reviews)

Isoxazole, 4-(chloromethyl)-5-cyclopropyl-3-(2,6-dichlorophenyl)-

CAS No.:

1268245-50-6

Catalog Number:

AG000TA7

Molecular Formula:

C13H10Cl3NO

Molecular Weight:

302.5836

Catalog Number:

AG000TA7

Chemical Name:

Isoxazole, 4-(chloromethyl)-5-cyclopropyl-3-(2,6-dichlorophenyl)-

CAS Number:

1268245-50-6

Molecular Formula:

C13H10Cl3NO

Molecular Weight:

302.5836

MDL Number:

MFCD30531308

IUPAC Name:

4-(chloromethyl)-5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazole

InChI:

InChI=1S/C13H10Cl3NO/c14-6-8-12(17-18-13(8)7-4-5-7)11-9(15)2-1-3-10(11)16/h1-3,7H,4-6H2

InChI Key:

MDFXZDUEXDDCOP-UHFFFAOYSA-N

SMILES:

ClCc1c(onc1c1c(Cl)cccc1Cl)C1CC1

Complexity:

290

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

300.983g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

302.579g/mol

Monoisotopic Mass:

300.983g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3