200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 33617-67-3
33617-67-3 | Benzene,1,3-dimethoxy-2-(methylthio)-
CAS No: 33617-67-3 Catalog No: AG007DIQ MDL No:MFCD00010334
Product Description
Catalog Number:
AG007DIQ
Chemical Name:
Benzene,1,3-dimethoxy-2-(methylthio)-
CAS Number:
33617-67-3
Molecular Formula:
C9H12O2S
Molecular Weight:
184.2554
MDL Number:
MFCD00010334
IUPAC Name:
1,3-dimethoxy-2-methylsulfanylbenzene
InChI:
InChI=1S/C9H12O2S/c1-10-7-5-4-6-8(11-2)9(7)12-3/h4-6H,1-3H3
InChI Key:
UASQOZQFGVJMFY-UHFFFAOYSA-N
SMILES:
CSc1c(OC)cccc1OC
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.056g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.253g/mol
Monoisotopic Mass:
184.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
© 2019 Angene International Limited. All rights Reserved.