3'-(Chloromethyl)-2,6-dimethyl-4-[3-(methylsulfonyl)propoxy]biphenyl - CAS 1394138-49-8
Catalog: |
BB008943 |
Product Name: |
3'-(Chloromethyl)-2,6-dimethyl-4-[3-(methylsulfonyl)propoxy]biphenyl |
CAS: |
1394138-49-8 |
Synonyms: |
2-[3-(chloromethyl)phenyl]-1,3-dimethyl-5-(3-methylsulfonylpropoxy)benzene; 2-[3-(chloromethyl)phenyl]-1,3-dimethyl-5-(3-methylsulfonylpropoxy)benzene |
IUPAC Name: | 2-[3-(chloromethyl)phenyl]-1,3-dimethyl-5-(3-methylsulfonylpropoxy)benzene |
Description: | 3'-(Chloromethyl)-2,6-dimethyl-4-[3-(methylsulfonyl)propoxy]biphenyl (CAS# 1394138-49-8 ) is a useful research chemical. |
Molecular Weight: | 366.90 |
Molecular Formula: | C19H23ClO3S |
Canonical SMILES: | CC1=CC(=CC(=C1C2=CC(=CC=C2)CCl)C)OCCCS(=O)(=O)C |
InChI: | InChI=1S/C19H23ClO3S/c1-14-10-18(23-8-5-9-24(3,21)22)11-15(2)19(14)17-7-4-6-16(12-17)13-20/h4,6-7,10-12H,5,8-9,13H2,1-3H3 |
InChI Key: | BTQUEFMXWXKWOG-UHFFFAOYSA-N |
LogP: | 5.60350 |
Publication Number | Title | Priority Date |
CN-105246875-A | Indane derivative, preparation method therefor, and pharmaceutical application thereof | 20130903 |
WO-2015032328-A1 | Indane derivative, preparation method therefor, and pharmaceutical application thereof | 20130903 |
CN-103012343-A | Fused-ring derivative and preparation method thereof as well as application of fused-ring derivative in medicine | 20110926 |
CN-103012343-B | Fused-ring derivative and preparation method thereof as well as application of fused-ring derivative in medicine | 20110926 |
AU-2012218401-A1 | Production method of optically active dihydrobenzofuran derivative | 20110217 |
Complexity: | 462 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 366.1056435 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 366.1056435 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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