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Home Other Building Blocks 4-Methoxy-α-toluenethiol

4-Methoxy-α-toluenethiol

CAS No.:
6258-60-2
Catalog Number:
AG00370L
Molecular Formula:
C8H10OS
Molecular Weight:
154.2294
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$56
- +
5g
98%
1 week
United States
$94
- +
25g
98%
1 week
United States
$205
- +
100g
98%
1 week
United States
$538
- +
Product Description
Catalog Number:
AG00370L
Chemical Name:
4-Methoxy-α-toluenethiol
CAS Number:
6258-60-2
Molecular Formula:
C8H10OS
Molecular Weight:
154.2294
MDL Number:
MFCD00004871
IUPAC Name:
(4-methoxyphenyl)methanethiol
InChI:
InChI=1S/C8H10OS/c1-9-8-4-2-7(6-10)3-5-8/h2-5,10H,6H2,1H3
InChI Key:
PTDVPWWJRCOIIO-UHFFFAOYSA-N
SMILES:
SCc1ccc(cc1)OC
EC Number:
228-393-6
Properties
Complexity:
87.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.045g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.227g/mol
Monoisotopic Mass:
154.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase. Bioorganic & medicinal chemistry letters 20100901
Regioselective and stereoselective nucleophilic ring opening reactions of a phenyl-substituted aziridine: enantioselective synthesis of beta-substituted tryptophan, cysteine, and serine derivatives. The Journal of organic chemistry 20020222
Facile synthesis of beta-cyclodextrin dithiols. Bioorganic & medicinal chemistry letters 20020121
Properties