Home Aldehydes Thiophene-3-carbaldehyde

Thiophene-3-carbaldehyde

CAS No.:
498-62-4
Catalog Number:
AG0033S9
Molecular Formula:
C5H4OS
Molecular Weight:
112.1497
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$38
- +
100g
98%
In Stock USA
United States
$113
- +
500g
98%
In Stock USA
United States
$498
- +
Product Description
Catalog Number:
AG0033S9
Chemical Name:
Thiophene-3-carbaldehyde
CAS Number:
498-62-4
Molecular Formula:
C5H4OS
Molecular Weight:
112.1497
MDL Number:
MFCD00005466
IUPAC Name:
thiophene-3-carbaldehyde
InChI:
InChI=1S/C5H4OS/c6-3-5-1-2-7-4-5/h1-4H
InChI Key:
RBIGKSZIQCTIJF-UHFFFAOYSA-N
SMILES:
O=Cc1cscc1
EC Number:
207-865-5
NSC Number:
172858
Properties
Complexity:
72.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.998g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.146g/mol
Monoisotopic Mass:
111.998g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
3-[(2-Formyl-thio-phen-3-yl)(hy-droxy)meth-yl]thio-phene-2-carbaldehyde. Acta crystallographica. Section E, Structure reports online 20120101
(1E,4E)-1,5-Bis(thio-phen-3-yl)penta-1,4-dien-3-one. Acta crystallographica. Section E, Structure reports online 20110901
3-Hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(thiophen-3-yl)methyl]-5,5-dimethylcyclohex-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20110701
Tetrabutylammonium fluoride (TBAF)-catalyzed addition of substituted trialkylsilylalkynes to aldehydes, ketones, and trifluoromethyl ketones. The Journal of organic chemistry 20110603
4-Hy-droxy-3-[(4-hy-droxy-2-oxo-2H-3-chromen-yl)(3-thien-yl)meth-yl]-2H-chromen-2-one. Acta crystallographica. Section E, Structure reports online 20110501
1-Benzyl-3,5-bis-[(E)-3-thienyl-methyl-idene]piperidin-4-one. Acta crystallographica. Section E, Structure reports online 20110301
4-Hy-droxy-3-[(4-hy-droxy-6-methyl-2-oxo-3,6-dihydro-2H-pyran-3-yl)(3-thien-yl)meth-yl]-6-methyl-3,6-dihydro-2H-pyran-2-one. Acta crystallographica. Section E, Structure reports online 20110201
Tris{2-[(3-thien-yl)methyl-idene-amino]-eth-yl}amine. Acta crystallographica. Section E, Structure reports online 20101101
3-Methyl-4-[(E)-3-thien-ylmethyl-idene-amino]-1H-1,2,4-triazole-5(4H)-thione. Acta crystallographica. Section E, Structure reports online 20101101
Adsorption and separation of reactive aromatic isomers and generation and stabilization of their radicals within cadmium(II)-triazole metal-organic confined space in a single-crystal-to-single-crystal fashion. Journal of the American Chemical Society 20100526
N'-(3-Thienylmethyl-ene)pyridine-2-carbohydrazide. Acta crystallographica. Section E, Structure reports online 20080401
Synthesis of heteroaryl imines: theoretical and experimental approach to the determination of the configuration of C=N double bond. The Journal of organic chemistry 20060915
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Synthesis, photochemical synthesis and antitumor evaluation of novel derivatives of thieno[3',2':4,5]thieno[2,3-c]quinolones. Chemical & pharmaceutical bulletin 20020501
Properties