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Home Aldehydes 5-Chlorothiophene-2-carbaldehyde

5-Chlorothiophene-2-carbaldehyde

CAS No.:
7283-96-7
Catalog Number:
AG00349C
Molecular Formula:
C5H3ClOS
Molecular Weight:
146.5947
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$35
- +
25g
95%
In Stock USA
United States
$112
- +
Product Description
Catalog Number:
AG00349C
Chemical Name:
5-Chlorothiophene-2-carbaldehyde
CAS Number:
7283-96-7
Molecular Formula:
C5H3ClOS
Molecular Weight:
146.5947
MDL Number:
MFCD00047090
IUPAC Name:
5-chlorothiophene-2-carbaldehyde
InChI:
InChI=1S/C5H3ClOS/c6-5-2-1-4(3-7)8-5/h1-3H
InChI Key:
VWYFITBWBRVBSW-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)C=O
EC Number:
230-708-7
Properties
Complexity:
96.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.959g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.588g/mol
Monoisotopic Mass:
145.959g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
N,N'-Bis[(E)-(5-chloro-2-thienyl)methyl-idene]ethane-1,2-diamine. Acta crystallographica. Section E, Structure reports online 20101101
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties