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Home Nitriles 2-(Benzo[d]oxazol-2-yl)acetonitrile

2-(Benzo[d]oxazol-2-yl)acetonitrile

CAS No.:
15344-56-6
Catalog Number:
AG00AQ2T
Molecular Formula:
C9H6N2O
Molecular Weight:
158.1567
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$122
- +
250mg
95%
In Stock USA
United States
$169
- +
1g
95%
In Stock USA
United States
$475
- +
5g
95%
In Stock USA
United States
$1400
- +
10g
95%
In Stock USA
United States
$2063
- +
Product Description
Catalog Number:
AG00AQ2T
Chemical Name:
2-(Benzo[d]oxazol-2-yl)acetonitrile
CAS Number:
15344-56-6
Molecular Formula:
C9H6N2O
Molecular Weight:
158.1567
MDL Number:
MFCD00160031
IUPAC Name:
2-(1,3-benzoxazol-2-yl)acetonitrile
InChI:
InChI=1S/C9H6N2O/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5H2
InChI Key:
NGUJPJCKRWSDCS-UHFFFAOYSA-N
SMILES:
N#CCc1nc2c(o1)cccc2
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.16g/mol
Monoisotopic Mass:
158.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and antimicrobial activity of meso-substituted polymethine cyanine dyes. Bioorganic chemistry 20040801
Properties