Home Other Building Blocks 4-Methoxythiophenol

4-Methoxythiophenol

CAS No.:
696-63-9
Catalog Number:
AG00343E
Molecular Formula:
C7H8OS
Molecular Weight:
140.2028
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Product Description
Catalog Number:
AG00343E
Chemical Name:
4-Methoxythiophenol
CAS Number:
696-63-9
Molecular Formula:
C7H8OS
Molecular Weight:
140.2028
MDL Number:
MFCD00004849
IUPAC Name:
4-methoxybenzenethiol
InChI:
InChI=1S/C7H8OS/c1-8-6-2-4-7(9)5-3-6/h2-5,9H,1H3
InChI Key:
NIFAOMSJMGEFTQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S
EC Number:
211-799-2
UNII:
68N68LMU0G
NSC Number:
100727
Properties
Complexity:
77  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.03g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.2g/mol
Monoisotopic Mass:
140.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
1-Meth-oxy-4-({[(4-meth-oxy-phen-yl)-sulfan-yl](phen-yl)meth-yl}sulfan-yl)benzene. Acta crystallographica. Section E, Structure reports online 20120301
2-(4-Methoxy-phenyl-sulfin-yl)cyclo-hexan-1-one. Acta crystallographica. Section E, Structure reports online 20090501
Screening for the calstabin-ryanodine receptor complex stabilizers JTV-519 and S-107 in doping control analysis. Drug testing and analysis 20090101
4-Methoxy-phenyl 2,3,4,6-tetra-O-acetyl-1-thio-α-d-mannopyran-oside. Acta crystallographica. Section E, Structure reports online 20080801
trans-Bis(4-methoxy-thio-phenolato-κS)bis-(trimethyl-phosphine-κP)nickel(II). Acta crystallographica. Section E, Structure reports online 20080201
Synthesis of (2E)-2-methyl-3-(4-([4-(quinolin-2-ylmethoxy)phenyl]sulfanyl)phenyl)prop-2-enoic acid (VUFB 20609) and 2-methyl-3-(4-([4-(quinolin-2-ylmethoxy)phenyl]sulfanyl)phenyl)propanoic acid (VUFB 20584) as potential antileukotrienic agents. The Journal of pharmacy and pharmacology 20040601
Synthesis and characterization of novel oxotechnetium (99Tc and 99mTc) and oxorhenium complexes from the 2,2'-bipyridine (NN)/thiol (S) mixed-ligand system. Inorganic chemistry 20030908
Novel oxorhenium and oxotechnetium complexes from an aminothiol[NS]/thiol[S] mixed-ligand system. Chemistry (Weinheim an der Bergstrasse, Germany) 20010903
Properties