Name: Name:4,5-Pyrimidinediamine,6-chloro-2-(trifluoromethyl)-
Brand: Angene
SKU: AG005FKE
Rating: 90 (10 reviews)

4,5-Pyrimidinediamine,6-chloro-2-(trifluoromethyl)-

CAS No.:

709-57-9

Catalog Number:

AG005FKE

Molecular Formula:

C5H4ClF3N4

Molecular Weight:

212.5603

Catalog Number:

AG005FKE

Chemical Name:

4,5-Pyrimidinediamine,6-chloro-2-(trifluoromethyl)-

CAS Number:

709-57-9

Molecular Formula:

C5H4ClF3N4

Molecular Weight:

212.5603

MDL Number:

MFCD08436614

IUPAC Name:

6-chloro-2-(trifluoromethyl)pyrimidine-4,5-diamine

InChI:

InChI=1S/C5H4ClF3N4/c6-2-1(10)3(11)13-4(12-2)5(7,8)9/h10H2,(H2,11,12,13)

InChI Key:

ZJMHKSNURAZUDJ-UHFFFAOYSA-N

SMILES:

Nc1nc(nc(c1N)Cl)C(F)(F)F

NSC Number:

56144

Complexity:

187

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.008g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.56g/mol

Monoisotopic Mass:

212.008g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1