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Ethyl red

CAT: 0931-T88894-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T88894-03Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
76058-33-8
Target
Others
Related Pathways
Others
Bioactivity
Ethyl red (Diethyl red) is a pH indicator.
Smiles
O=C(O)C=1C=CC=CC1N=NC2=CC=C(C=C2)N(CC)CC
Molecular Formula
C17H19N3O2
Molecular Weight
297.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ethyl red
CAS Number76058-33-8
PubChem CID54832
IUPAC Name2-[[4-(diethylamino)phenyl]diazenyl]benzoic acid
Molecular FormulaC17H19N3O2
Molecular Weight297.35
XLogP4.1
Topological Polar Surface Area65.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity374
SMILES
CCN(CC)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O
InChI
InChI=1S/C17H19N3O2/c1-3-20(4-2)14-11-9-13(10-12-14)18-19-16-8-6-5-7-15(16)17(21)22/h5-12H,3-4H2,1-2H3,(H,21,22)
InChIKey
HBRCDTRQDHMTDA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl red
CAS: 76058-33-8
CID: 54832
Formula: C17H19N3O2
MW: 297.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight297.35
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass297.147726857
Monoisotopic Mass297.147726857
Topological Polar Surface Area65.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity374
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

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