Home Halogens (6-bromo-1,3-benzoxazol-2-yl)methanol

(6-bromo-1,3-benzoxazol-2-yl)methanol

CAS No.:
1086393-57-8
Catalog Number:
AG01BAVE
Molecular Formula:
C8H6BrNO2
Molecular Weight:
228.0427
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BAVE
Chemical Name:
(6-bromo-1,3-benzoxazol-2-yl)methanol
CAS Number:
1086393-57-8
Molecular Formula:
C8H6BrNO2
Molecular Weight:
228.0427
MDL Number:
MFCD11226120
IUPAC Name:
(6-bromo-1,3-benzoxazol-2-yl)methanol
InChI:
InChI=1S/C8H6BrNO2/c9-5-1-2-6-7(3-5)12-8(4-11)10-6/h1-3,11H,4H2
InChI Key:
VLOCHTRDDAURDT-UHFFFAOYSA-N
SMILES:
OCc1nc2c(o1)cc(cc2)Br
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.958g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.045g/mol
Monoisotopic Mass:
226.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties