Name: Name:5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBONYL CHLORIDE
Brand: Angene
SKU: AG00C85V
Rating: 90 (10 reviews)

5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBONYL CHLORIDE

CAS No.:

36401-55-5

Catalog Number:

AG00C85V

Molecular Formula:

C10H8ClN3O

Molecular Weight:

221.6430

Catalog Number:

AG00C85V

Chemical Name:

5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBONYL CHLORIDE

CAS Number:

36401-55-5

Molecular Formula:

C10H8ClN3O

Molecular Weight:

221.6430

MDL Number:

MFCD00052545

IUPAC Name:

5-methyl-2-phenyltriazole-4-carbonyl chloride

InChI:

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

InChI Key:

UJYBUZMRRLFXGM-UHFFFAOYSA-N

SMILES:

ClC(=O)c1nn(nc1C)c1ccccc1

Complexity:

243

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:

3.1