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7774-74-5,MFCD00051666
Catalog No.:AA003HVJ
7774-74-5 | 2-Thiophenethiol
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
90%
1 week  
$68.00   $48.00
- +
5g
90%
1 week  
$106.00   $74.00
- +
25g
90%
1 week  
$240.00   $168.00
- +
100g
90%
1 week  
$633.00   $443.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HVJ
Chemical Name:
2-Thiophenethiol
CAS Number:
7774-74-5
Molecular Formula:
C4H4S2
Molecular Weight:
116.2046
MDL Number:
MFCD00051666
IUPAC Name:
thiophene-2-thiol
InChI:
InChI=1S/C4H4S2/c5-4-2-1-3-6-4/h1-3,5H
InChI Key:
SWEDAZLCYJDAGW-UHFFFAOYSA-N
SMILES:
Sc1cccs1
EC Number:
231-881-1
UNII:
F3LB1437XQ
FEMA Number:
3062
Properties
Computed Properties
 
Complexity:
44.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.975g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
116.196g/mol
Monoisotopic Mass:
115.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
Thiophene-2-thiol 
2-Mercaptothiophene 
2-Sulphanylthiophene 
F3LB1437XQ 
SWEDAZLCYJDAGW-UHFFFAOYSA-N 
MFCD00051666 
alpha-Thienyl mercaptan 
thiophene thiol 
FEMA No. 3062 
2-Thiothiophene 
thiophen-2-thiol 
2-thienylmercaptan 
2-Thiophenethiol 
EINECS 231-881-1 
2-mercapto thiophene 
2-mercapto-thiophene 
PubChem7755 
2-Thienyl hydrosulfide 
ACMC-209pbe 
AC1LAX8K 
.alpha.-Thienyl mercaptan 
2-Thienyl hydrosulfide # 
AC1Q7G9O 
7774-74-5 
SCHEMBL139805 
C4H4S2 
CTK2H4556 
FEMA 3062 
KS-00000VEA 
DTXSID40228362 
2-Thiophenethiol, >=90%, FG 
EBD52685 
STR03022 
ZINC2169156 
thiophenethiol 
2-Mercaptothiophene; Thienylmercaptan 
ANW-37080 
SBB059094 
AKOS009156526 
LS21100 
MCULE-8882266878 
NE11053 
PS-4717 
RP19253 
RTC-020857 
2-Thienyl mercaptan 
TRA0046176 
VT20135 
AJ-33941 
AN-24939 
BP-10239 
SC-06762 
TL806213 
AB0007459 
AB1005975 
DB-006174 
2-Thienylthiol 
TC-020857 
A9824 
FT-0081200 
FT-0612776 
ST24050173 
ST51044237 
X6185 
EN300-31767 
I09-0036 
I09-1890 
Thienylmercaptan 
J-640128 
J-800132 
Q-100826 
Thiophene-2-thiol; 2-Thienylmercaptan; 2-Mercaptothiophene 
70688-48-1 
thiophen-2-ylmethanethiol 
C4-H4-S2 
Ethyl 1,3-dithiolane-2-carboxylate 
CID522674 
ACN-031798 
2-thiophene thiol 
2-Thiophenethiol, 98% - 25G 25g 
T1680 
2-Thiophenethiol (6CI, 7CI, 8CI, 9CI) 
6258-63-5 
UNII-F3LB1437XQ 
Literature

Title: Local electronic properties at organic-metal interfaces: thiophene derivatives on Pt(111).

Journal: Physical chemistry chemical physics : PCCP 20121128

Title: 2-(Thio-phen-2-yl)-1-(thio-phen-2-ylmeth-yl)-1H-benzimidazole.

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: Inactivation of cytochrome P450 (P450) 3A4 but not P450 3A5 by OSI-930, a thiophene-containing anticancer drug.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20110201

Title: Differential reactivity of thiophene-2-carboxylic and thiophene-3-carboxylic acids: Results from DFT and Hartree-Fock theory.

Journal: Journal of molecular graphics & modelling 20100226

Title: Let's not forget tautomers.

Journal: Journal of computer-aided molecular design 20091001

Title: [Review on the tastes and odors compounds in drinking water of China].

Journal: Huan jing ke xue= Huanjing kexue 20090215

Title: New volatile sulfur-containing constituents in a simultaneous distillation-extraction extract of red bell peppers (Capsicum annuum).

Journal: Journal of agricultural and food chemistry 20080123

Title: Thiol- and thioether-based bifunctional chelates for the {M(CO)3}+ core (M = Tc, Re).

Journal: Inorganic chemistry 20050919

Title: Chelation in metal intoxication XLVI: synthesis of some alpha-mercapto-beta-substituted aryl acrylic acids and their in vitro cadmium chelating ability.

Journal: Biomedical and environmental sciences : BES 20040301

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