Home Aldehydes 2-(2-Benzoxazolyl)malondialdehyde

2-(2-Benzoxazolyl)malondialdehyde

CAS No.:
40071-07-6
Catalog Number:
AG00I7UP
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$110
- +
5g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00I7UP
Chemical Name:
2-(2-Benzoxazolyl)malondialdehyde
CAS Number:
40071-07-6
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
MDL Number:
MFCD00216526
IUPAC Name:
2-(1,3-benzoxazol-2-yl)propanedial
InChI:
InChI=1S/C10H7NO3/c12-5-7(6-13)10-11-8-3-1-2-4-9(8)14-10/h1-7H
InChI Key:
MEERYQZEXZMOGC-UHFFFAOYSA-N
SMILES:
O=CC(c1nc2c(o1)cccc2)C=O
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties