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Home Aldehydes 3-(2-Chloro-phenyl)-isoxazole-5-carbaldehyde

3-(2-Chloro-phenyl)-isoxazole-5-carbaldehyde

CAS No.:
377051-52-0
Catalog Number:
AG00BYVY
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 97% (HPLC)
1 week
United States
$140
- +
1g
≥ 97% (HPLC)
1 week
United States
$243
- +
5g
≥ 97% (HPLC)
1 week
United States
$988
- +
10g
≥ 97% (HPLC)
1 week
United States
$1880
- +
Product Description
Catalog Number:
AG00BYVY
Chemical Name:
3-(2-Chloro-phenyl)-isoxazole-5-carbaldehyde
CAS Number:
377051-52-0
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
MDL Number:
MFCD06738515
IUPAC Name:
3-(2-chlorophenyl)-1,2-oxazole-5-carbaldehyde
InChI:
InChI=1S/C10H6ClNO2/c11-9-4-2-1-3-8(9)10-5-7(6-13)14-12-10/h1-6H
InChI Key:
CJJVDXAJEFUZRU-UHFFFAOYSA-N
SMILES:
O=Cc1onc(c1)c1ccccc1Cl
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.009g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.613g/mol
Monoisotopic Mass:
207.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Discovery of substituted isoxazolecarbaldehydes as potent spermicides, acrosin inhibitors and mild anti-fungal agents. Human reproduction (Oxford, England) 20050801
Properties