[Go]
PubMed | Entrez | Structure | PubChem | Help
PubChem  » Substance Summary
 


N,N-dimethylthioformamide - Substance Summary (SID 211977)

structure in first source


Drug and Chemical Information: (Total:1)         

Safety and Toxicology

EINECS - European Inventory of Existing Commercial Chemical Substances


Literature

Literature Keyword Mining Tool



Data Source:   
Depositor: ChemIDplus
External ID: 000758167

Depositor-Supplied Synonyms: (Total: 7)
Sort:
Dimethylthioformamide
N,N-dimethylthioformamide
Methanethioamide, N,N-dimethyl-
EINECS 212-060-7
Formamide, N,N-dimethylthio- (8CI)
NSC 402082
758-16-7


Properties Computed from Structure:
Molecular Weight89.15938 [g/mol]
Molecular FormulaC3H7NS
XLogP3-AA0.3
H-Bond Donor0
H-Bond Acceptor0
Rotatable Bond Count0
Exact Mass89.02992
MonoIsotopic Mass89.02992
Topological Polar Surface Area3.2
Heavy Atom Count5
Formal Charge0
Complexity33.9
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: N,N-dimethylmethanethioamide
Canonical SMILES: CN(C)C=S
InChI: InChI=1S/C3H7NS/c1-4(2)3-5/h3H,1-2H3
InChIKey: SKECXRFZFFAANN-UHFFFAOYSA-N


Substance Information:
SID 211977   
Deposit Date: 2005-08-08
Modify Date: 2006-04-28

CID 69794   
Create Date: 2005-03-26

Related Substances:
Same: 17 Links

Similar Substances: 17 Links

     
Compound Displayed

2D

3D
Compound ID69794
Molecular Weight89.15938 [g/mol]
Molecular FormulaC3H7NS
XLogP3-AA0.3
H-Bond Donor0
H-Bond Acceptor0


 Write to Helpdesk | Disclaimer | Privacy statement | Accessibility