200,000+ products from a single source!
sales@angenechem.com
138485-83-3 | 1H-Inden-1-one, 3-bromo-6-(methylthio)-
CAS No: 138485-83-3 Catalog No: AG00198Z MDL No:
Product Description
Catalog Number:
AG00198Z
Chemical Name:
1H-Inden-1-one, 3-bromo-6-(methylthio)-
CAS Number:
138485-83-3
Molecular Formula:
C10H7BrOS
Molecular Weight:
255.1310
IUPAC Name:
3-bromo-6-methylsulfanylinden-1-one
InChI:
InChI=1S/C10H7BrOS/c1-13-6-2-3-7-8(4-6)10(12)5-9(7)11/h2-5H,1H3
InChI Key:
GOOALRWTSANSEP-UHFFFAOYSA-N
SMILES:
CSc1ccc2c(c1)C(=O)C=C2Br
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.94g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.129g/mol
Monoisotopic Mass:
253.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.