Home Other Building Blocks Benzoxazole, 2-methyl-5-(trifluoromethyl)-

Benzoxazole, 2-methyl-5-(trifluoromethyl)-

CAS No.:
175785-41-8
Catalog Number:
AG00216O
Molecular Formula:
C9H6F3NO
Molecular Weight:
201.1452
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00216O
Chemical Name:
Benzoxazole, 2-methyl-5-(trifluoromethyl)-
CAS Number:
175785-41-8
Molecular Formula:
C9H6F3NO
Molecular Weight:
201.1452
MDL Number:
MFCD09222481
IUPAC Name:
2-methyl-5-(trifluoromethyl)-1,3-benzoxazole
InChI:
InChI=1S/C9H6F3NO/c1-5-13-7-4-6(9(10,11)12)2-3-8(7)14-5/h2-4H,1H3
InChI Key:
SAEYCFGBSOYYAM-UHFFFAOYSA-N
SMILES:
Cc1oc2c(n1)cc(cc2)C(F)(F)F
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.148g/mol
Monoisotopic Mass:
201.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties