Tyrphostin A23

CAT: 0024-sc-3554Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-3554Size:10 mg

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CAS Number

118409-57-7

Chemical Information

Tyrphostin 23

2-[(3,4-dihydroxyphenyl)methylidene]propanedinitrile is a member of catechols.

CAS Number	118409-57-7
PubChem CID	2052
IUPAC Name	2-[(3,4-dihydroxyphenyl)methylidene]propanedinitrile
Molecular Formula	C10H6N2O2
Molecular Weight	186.17
XLogP	1.3
Topological Polar Surface Area	88
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	313

SMILES

C1=CC(=C(C=C1C=C(C#N)C#N)O)O

InChI

InChI=1S/C10H6N2O2/c11-5-8(6-12)3-7-1-2-9(13)10(14)4-7/h1-4,13-14H

InChIKey

VTJXFTPMFYAJJU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 118409-57-7

CID: 2052

Formula: C10H6N2O2

MW: 186.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	186.17
XLogP3	1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	186.042927438
Monoisotopic Mass	186.042927438
Topological Polar Surface Area	88 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	313
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes