Name: Name:1-(2-chloro-4-(4-chlorophenoxy)phenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol
Brand: Angene
SKU: AG009713
Rating: 90 (10 reviews)

1-(2-chloro-4-(4-chlorophenoxy)phenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol

CAS No.:

117018-19-6

Catalog Number:

AG009713

Molecular Formula:

C16H13Cl2N3O2

Molecular Weight:

350.1993

Catalog Number:

AG009713

Chemical Name:

1-(2-chloro-4-(4-chlorophenoxy)phenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol

CAS Number:

117018-19-6

Molecular Formula:

C16H13Cl2N3O2

Molecular Weight:

350.1993

MDL Number:

MFCD28411670

IUPAC Name:

1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1,2,4-triazol-1-yl)ethanol

InChI:

InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2

InChI Key:

NBYSKMWDHCZSIP-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)Oc1ccc(c(c1)Cl)C(Cn1cncn1)O

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

349.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

350.199g/mol

Monoisotopic Mass:

349.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6