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C.I. Solvent Red 25

CAT: 0024-sc-493267Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-493267Size:1 g
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CAS Number
3176-79-2

Chemical Information

Solvent Red 25
CAS Number3176-79-2
PubChem CID99631
IUPAC Name1-[[3-methyl-4-[(3-methylphenyl)diazenyl]phenyl]diazenyl]naphthalen-2-ol
Molecular FormulaC24H20N4O
Molecular Weight380.4
XLogP7.1
Topological Polar Surface Area69.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity579
SMILES
CC1=CC(=CC=C1)N=NC2=C(C=C(C=C2)N=NC3=C(C=CC4=CC=CC=C43)O)C
InChI
InChI=1S/C24H20N4O/c1-16-6-5-8-19(14-16)25-27-22-12-11-20(15-17(22)2)26-28-24-21-9-4-3-7-18(21)10-13-23(24)29/h3-15,29H,1-2H3
InChIKey
NHXXLZBKTKNTEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Solvent Red 25
CAS: 3176-79-2
CID: 99631
Formula: C24H20N4O
MW: 380.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight380.4
XLogP37.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass380.16371127
Monoisotopic Mass380.16371127
Topological Polar Surface Area69.7 Ų
Heavy Atom Count29
Formal Charge0
Complexity579
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes