200,000+ products from a single source!
sales@angenechem.com
1152551-04-6 | 2-(1,3-BENZOXAZOL-2-YL)-1-(3-METHYLTHIOPHEN-2-YL)ETHAN-1-ONE
CAS No: 1152551-04-6 Catalog No: AG01EJXR MDL No:MFCD10693243
Product Description
Catalog Number:
AG01EJXR
Chemical Name:
2-(1,3-BENZOXAZOL-2-YL)-1-(3-METHYLTHIOPHEN-2-YL)ETHAN-1-ONE
CAS Number:
1152551-04-6
Molecular Formula:
C14H11NO2S
Molecular Weight:
257.3076
MDL Number:
MFCD10693243
IUPAC Name:
2-(1,3-benzoxazol-2-yl)-1-(3-methylthiophen-2-yl)ethanone
InChI:
InChI=1S/C14H11NO2S/c1-9-6-7-18-14(9)11(16)8-13-15-10-4-2-3-5-12(10)17-13/h2-7H,8H2,1H3
InChI Key:
UBPSVRIWJXLXCI-UHFFFAOYSA-N
SMILES:
O=C(c1sccc1C)Cc1nc2c(o1)cccc2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.051g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.307g/mol
Monoisotopic Mass:
257.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.