200,000+ products from a single source!
sales@angenechem.com
502658-76-6 | Phenol, 4-(5-isoxazolyl)- (9CI)
CAS No: 502658-76-6 Catalog No: AG00E7N4 MDL No:
Product Description
Catalog Number:
AG00E7N4
Chemical Name:
Phenol, 4-(5-isoxazolyl)- (9CI)
CAS Number:
502658-76-6
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
IUPAC Name:
4-(1,2-oxazol-5-yl)phenol
InChI:
InChI=1S/C9H7NO2/c11-8-3-1-7(2-4-8)9-5-6-10-12-9/h1-6,11H
InChI Key:
FVIYAEXWKAXWOM-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1ccno1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.