Name: Name:Pigment red 146
Brand: Angene
SKU: AG01E6GZ
Rating: 90 (10 reviews)

Pigment red 146

CAS No.:

5280-68-2

Catalog Number:

AG01E6GZ

Molecular Formula:

C33H27ClN4O6

Molecular Weight:

611.0437

Catalog Number:

AG01E6GZ

Chemical Name:

Pigment red 146

CAS Number:

5280-68-2

Molecular Formula:

C33H27ClN4O6

Molecular Weight:

611.0437

MDL Number:

MFCD00071995

IUPAC Name:

N-(4-chloro-2,5-dimethoxyphenyl)-3-hydroxy-4-[[2-methoxy-5-(phenylcarbamoyl)phenyl]diazenyl]naphthalene-2-carboxamide

InChI:

InChI=1S/C33H27ClN4O6/c1-42-27-14-13-20(32(40)35-21-10-5-4-6-11-21)16-26(27)37-38-30-22-12-8-7-9-19(22)15-23(31(30)39)33(41)36-25-18-28(43-2)24(34)17-29(25)44-3/h4-18,39H,1-3H3,(H,35,40)(H,36,41)

InChI Key:

HEKSHDRHZRCZBN-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1/N=N/c1c(O)c(cc2c1cccc2)C(=O)Nc1cc(OC)c(cc1OC)Cl)C(=O)Nc1ccccc1

EC Number:

226-103-2

Complexity:

982

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

610.162g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

611.051g/mol

Monoisotopic Mass:

610.162g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

131A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.4