Home Other Building Blocks [3-(4-Nitro-phenyl)-isoxazol-5-yl]-methanol

[3-(4-Nitro-phenyl)-isoxazol-5-yl]-methanol

CAS No.:
605663-76-1
Catalog Number:
AG00E9YK
Molecular Formula:
C10H8N2O4
Molecular Weight:
220.1815
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 97%
1 week
United States
$111
- +
Product Description
Catalog Number:
AG00E9YK
Chemical Name:
[3-(4-Nitro-phenyl)-isoxazol-5-yl]-methanol
CAS Number:
605663-76-1
Molecular Formula:
C10H8N2O4
Molecular Weight:
220.1815
MDL Number:
MFCD06738494
IUPAC Name:
[3-(4-nitrophenyl)-1,2-oxazol-5-yl]methanol
InChI:
InChI=1S/C10H8N2O4/c13-6-9-5-10(11-16-9)7-1-3-8(4-2-7)12(14)15/h1-5,13H,6H2
InChI Key:
CQRBUCNIAWIELB-UHFFFAOYSA-N
SMILES:
OCc1onc(c1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.048g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.184g/mol
Monoisotopic Mass:
220.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties