ChemicalBook--->CAS DataBase List--->498-62-4

498-62-4

498-62-4 Structure

498-62-4 Structure
IdentificationMore
[Name]

3-Thiophenecarboxaldehyde
[CAS]

498-62-4
[Synonyms]

3-THIOPHENALDEHYDE
3-THIOPHENEALDEHYDE
3-THIOPHENECARBALDEHYDE
3-THIOPHENECARBOXALDEHYDE
RARECHEM AM LA 0011
THIOPHENE-3-ALDEHYDE
THIOPHENE-3-CARBALDEHYDE
THIOPHENE-3-CARBOXALDEHYDE
TIMTEC-BB SBB004320
3-Formylthiophene
3-Thenaldehyde
3-Thienophenecarboxyaldehyde
3-thiophene carboxyaldehyde
thiophen-3-carboxaldehyde
Thiophene-3-carboxaldehyde,96%
Thiophene-3-carboxaldehyde 98%
3-THIOPHENE CARBOXALDEHYDE 98%
Thiophene-4-carbaldehyde
[EINECS(EC#)]

207-865-5
[Molecular Formula]

C5H4OS
[MDL Number]

MFCD00005466
[Molecular Weight]

112.15
[MOL File]

498-62-4.mol
Chemical PropertiesBack Directory
[Appearance]

clear yellow to light brown liquid
[Melting point ]

-30 °C
[Boiling point ]

194-196 °C (lit.) 86-87 °C/20 mmHg (lit.)
[density ]

1.28 g/mL at 25 °C(lit.)
[vapor pressure ]

0.31 mm Hg ( 20 °C)
[refractive index ]

n20/D 1.583(lit.)
[Fp ]

165 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform, Hexanes
[form ]

Liquid
[color ]

Clear yellow to light brown
[Specific Gravity]

1.228
[Water Solubility ]

Not miscible in water.
[Sensitive ]

Air Sensitive
[Detection Methods]

GC,NMR
[BRN ]

105889
[InChI]

1S/C5H4OS/c6-3-5-1-2-7-4-5/h1-4H
[InChIKey]

RBIGKSZIQCTIJF-UHFFFAOYSA-N
[SMILES]

[H]C(=O)c1ccsc1
[LogP]

1.010
[CAS DataBase Reference]

498-62-4(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Thiophenecarboxaldehyde(498-62-4)
[Storage Precautions]

Air sensitive;Store under nitrogen
[EPA Substance Registry System]

498-62-4(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H335-H227-H315-H319-H302
[Precautionary statements ]

P210e-P261-P280a-P305+P351+P338-P405-P501a-P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R43:May cause sensitization by skin contact.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37:Wear suitable gloves .
S24:Avoid contact with skin .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[Autoignition Temperature]

>392 °F
[Hazard Note ]

Irritant
[TSCA ]

T
[HazardClass ]

AIR SENSITIVE
[HS Code ]

29349900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

(5-BROMOTHIOPHEN-3-YL)METHANESULFONYL CHLORIDE-->2-(3-THIENYL)ETHANAMINE-->2-NITROTHIOPHENE-4-CARBOXALDEHYDE-->3,4-Dithia-7H-cyclopenta[a]pentalene-->4,4-Dihexyl-4H-cyclopenta[1,2-b:5,4-b']dithiophene-->3-Thiophenecarboxaldehyde, 5-chloro--->THIENO[2,3-B]THIOPHENE-->METHYL 3-THIOPHENECARBOXYLATE 97-->3-(3-thienyl)pentanedioic acid-->FURAN-2-YL(THIOPHEN-3-YL)METHANOL-->1-(3-Thienyl)butane-1,2-dione-->Thiophene, 3-(2,2-dibromoethenyl)--->PHENYLAMINO-THIOPHEN-3-YL-ACETONITRILE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Thiophenecarboxaldehyde(498-62-4).msds
Hazard InformationBack Directory
[Chemical Properties]

clear yellow to light brown liquid
[Uses]

3-Thiophenecarboxaldehyde is used in biological studies to determine the volatile compounds formed from the interaction between organoselenium and sulfur compounds.
[Application]

3-Thiophenecarboxaldehyde is a versatile organic compound known for its unique thiophene ring structure, which imparts distinct chemical properties. This compound is widely utilized in the synthesis of various pharmaceuticals and agrochemicals, making it a valuable building block in organic chemistry.
[Definition]

ChEBI: An aldehyde that is thiophene substituted by a formyl group at position 3.
[Synthesis Reference(s)]

Journal of Medicinal Chemistry, 16, p. 1361, 1973 DOI: 10.1021/jm00270a009
Organic Syntheses, Coll. Vol. 4, p. 918, 1963
Spectrum DetailBack Directory
[Spectrum Detail]

3-Thiophenecarboxaldehyde(498-62-4)MS
3-Thiophenecarboxaldehyde(498-62-4)1HNMR
3-Thiophenecarboxaldehyde(498-62-4)13CNMR
3-Thiophenecarboxaldehyde(498-62-4)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Thiophenecarboxaldehyde, 98%(498-62-4)
[Alfa Aesar]

Thiophene-3-carboxaldehyde, 96%(498-62-4)
[Sigma Aldrich]

498-62-4(sigmaaldrich)
[TCI AMERICA]

3-Thiophenaldehyde,>98.0%(GC)(498-62-4)
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