Name: Name:1-[2-chloro-4-(1H-1,2,4-triazol-1-yl)phenyl]ethan-1-one
Brand: Angene
SKU: AG01A0IM
Rating: 90 (10 reviews)

1-[2-chloro-4-(1H-1,2,4-triazol-1-yl)phenyl]ethan-1-one

CAS No.:

1343189-32-1

Catalog Number:

AG01A0IM

Molecular Formula:

C10H8ClN3O

Molecular Weight:

221.6430

Catalog Number:

AG01A0IM

Chemical Name:

1-[2-chloro-4-(1H-1,2,4-triazol-1-yl)phenyl]ethan-1-one

CAS Number:

1343189-32-1

Molecular Formula:

C10H8ClN3O

Molecular Weight:

221.6430

MDL Number:

MFCD20297096

IUPAC Name:

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

InChI:

InChI=1S/C10H8ClN3O/c1-7(15)9-3-2-8(4-10(9)11)14-6-12-5-13-14/h2-6H,1H3

InChI Key:

VRKQGPMJMJOEAJ-UHFFFAOYSA-N

SMILES:

CC(=O)c1ccc(cc1Cl)n1cncn1

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.644g/mol

Monoisotopic Mass:

221.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: