200,000+ products from a single source!
sales@angenechem.com
122957-57-7 | 4-(4-methyl-1,3-thiazol-5-yl)benzonitrile
CAS No: 122957-57-7 Catalog No: AG01C1EI MDL No:MFCD29041978
Product Description
Catalog Number:
AG01C1EI
Chemical Name:
4-(4-methyl-1,3-thiazol-5-yl)benzonitrile
CAS Number:
122957-57-7
Molecular Formula:
C11H8N2S
Molecular Weight:
200.2596
MDL Number:
MFCD29041978
IUPAC Name:
4-(4-methyl-1,3-thiazol-5-yl)benzonitrile
InChI:
InChI=1S/C11H8N2S/c1-8-11(14-7-13-8)10-4-2-9(6-12)3-5-10/h2-5,7H,1H3
InChI Key:
REUDLMVWBUGLDA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1scnc1C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.259g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.