Home Aldehydes 5-(2-Thienyl)-3-isoxazolecarbaldehyde

5-(2-Thienyl)-3-isoxazolecarbaldehyde

CAS No.:
465514-11-8
Catalog Number:
AG00D9OH
Molecular Formula:
C8H5NO2S
Molecular Weight:
179.1958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98% (HPLC)
1 week
United States
$121
- +
250mg
≥ 98% (HPLC)
1 week
United States
$191
- +
1g
≥ 98% (HPLC)
1 week
United States
$385
- +
Product Description
Catalog Number:
AG00D9OH
Chemical Name:
5-(2-Thienyl)-3-isoxazolecarbaldehyde
CAS Number:
465514-11-8
Molecular Formula:
C8H5NO2S
Molecular Weight:
179.1958
MDL Number:
MFCD03086160
IUPAC Name:
5-thiophen-2-yl-1,2-oxazole-3-carbaldehyde
InChI:
InChI=1S/C8H5NO2S/c10-5-6-4-7(11-9-6)8-2-1-3-12-8/h1-5H
InChI Key:
ICENILRKNUKRPB-UHFFFAOYSA-N
SMILES:
O=Cc1noc(c1)c1cccs1
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.193g/mol
Monoisotopic Mass:
179.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties