200,000+ products from a single source!
sales@angenechem.com
139195-85-0 | Nickel, bis[2-[[1-(phenylazo)-2-butenyl]azo]benzothiazole]- (9CI)
CAS No: 139195-85-0 Catalog No: AG001AHA MDL No:
Product Description
Catalog Number:
AG001AHA
Chemical Name:
Nickel, bis[2-[[1-(phenylazo)-2-butenyl]azo]benzothiazole]- (9CI)
CAS Number:
139195-85-0
Molecular Formula:
C34H30N10NiS2
Molecular Weight:
701.4924
IUPAC Name:
1,3-benzothiazol-2-yl(1-phenyldiazenylbut-2-enyl)diazene;nickel
InChI:
InChI=1S/2C17H15N5S.Ni/c2*1-2-8-16(20-19-13-9-4-3-5-10-13)21-22-17-18-14-11-6-7-12-15(14)23-17;/h2*2-12,16H,1H3;
InChI Key:
UMNQACYKQSLBKF-UHFFFAOYSA-N
SMILES:
CC=CC(N=Nc1nc2c(s1)cccc2)N=Nc1ccccc1.CC=CC(N=Nc1nc2c(s1)cccc2)N=Nc1ccccc1.[Ni]
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
700.145g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
701.497g/mol
Monoisotopic Mass:
700.145g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
181A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.