Home Nitriles 2-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]acetonitrile

2-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]acetonitrile

CAS No.:
301235-86-9
Catalog Number:
AG007JHW
Molecular Formula:
C12H10N2OS
Molecular Weight:
230.2856
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 97% (NMR)
1 week
United States
$111
- +
250mg
≥ 97% (NMR)
1 week
United States
$177
- +
1g
≥ 97% (NMR)
1 week
United States
$301
- +
5g
≥ 97% (NMR)
1 week
United States
$1281
- +
Product Description
Catalog Number:
AG007JHW
Chemical Name:
2-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]acetonitrile
CAS Number:
301235-86-9
Molecular Formula:
C12H10N2OS
Molecular Weight:
230.2856
MDL Number:
MFCD00839066
IUPAC Name:
2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetonitrile
InChI:
InChI=1S/C12H10N2OS/c1-15-10-4-2-9(3-5-10)11-8-16-12(14-11)6-7-13/h2-5,8H,6H2,1H3
InChI Key:
PVJHQECSHPIPKG-UHFFFAOYSA-N
SMILES:
N#CCc1scc(n1)c1ccc(cc1)OC
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.285g/mol
Monoisotopic Mass:
230.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties