2,5-Diethoxyterephthalohydrazide

CAT: 0127-OR1010104-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1010104-01Size:250 mg

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CAS Number

1136292-71-1

MDL Number

MFCD31381058

Purity

97%

Smiles

CCOC1=C(C(NN)=O)C=C(OCC)C(C(NN)=O)=C1

Chemical Information

2,5-Diethoxyterephthalohydrazide

CAS Number	1136292-71-1
PubChem CID	101962189
IUPAC Name	2,5-diethoxybenzene-1,4-dicarbohydrazide
Molecular Formula	C12H18N4O4
Molecular Weight	282.30
XLogP	-0.3
Topological Polar Surface Area	129
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	20
Formal Charge	0
Complexity	307

SMILES

CCOC1=CC(=C(C=C1C(=O)NN)OCC)C(=O)NN

InChI

InChI=1S/C12H18N4O4/c1-3-19-9-5-8(12(18)16-14)10(20-4-2)6-7(9)11(17)15-13/h5-6H,3-4,13-14H2,1-2H3,(H,15,17)(H,16,18)

InChIKey

XSSPHNOJIAIZCR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1136292-71-1

CID: 101962189

Formula: C12H18N4O4

MW: 282.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	282.30
XLogP3	-0.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	282.13280507
Monoisotopic Mass	282.13280507
Topological Polar Surface Area	129 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	307
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

Catalog	Name
OR1079314	5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079313	5,5'''-Didecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079310	5,5'''-Didodecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1042721-01	[2,2':5',2''-Terthiophene]-5,5''-dicarboxaldehyde
OR1025484-01	5,5''-Diiodo-2,2':5',2''-Terthiophene
OR92625-01	5,5''-Dibromo-2,2':5',2''-terthiophene
OR1051600	5,5'''-Di-n-octyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1053628-01	2,2,5,5-Tetramethylcyclopentanone
OR1009882-01	2,2,5,5-Tetramethyltetrahydrofuran
OR1053063-01	1,2,5-Oxadithiolane 2,2,5,5-tetraoxide

Catalog	Name
LVB29271-01	2,5-Diethoxyterephthalohydrazide
sc-227020	5,5''-Dibromo-2,2':5',2''-terthiophene
sc-477057	2,2':5',2''-Terthiophene-5,5''-dicarboxaldehyde
sc-474109	2,2′:5′,2′′:5′′,2′′′-Quaterthiophene
FT172401-01	2,2,5,5-Tetramethyloxolane
JH160241	2,2',5,5'-Tetrachlorobenzidine
sc-265954	2,2',5,5'-Tetramethylbiphenyl
419550-01	2,2',5,5'-Tetrachlorobiphenyl
EAA37887-01	1, 2, 5-Oxadithiolane 2, 2, 5, 5-tetraoxide
JH464578	2,2,5,5-tetramethyl-1,2,5-oxadisilolane