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3-Thiophenamine

CAS No.:
17721-06-1
Catalog Number:
AG00256P
Molecular Formula:
C4H5NS
Molecular Weight:
99.1542
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Product Description
Catalog Number:
AG00256P
Chemical Name:
3-Thiophenamine
CAS Number:
17721-06-1
Molecular Formula:
C4H5NS
Molecular Weight:
99.1542
MDL Number:
MFCD11111630
IUPAC Name:
thiophen-3-amine
InChI:
InChI=1S/C4H5NS/c5-4-1-2-6-3-4/h1-3H,5H2
InChI Key:
DKGYESBFCGKOJC-UHFFFAOYSA-N
SMILES:
Nc1cscc1
Properties
Complexity:
46.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.014g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
99.151g/mol
Monoisotopic Mass:
99.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Aromatic amines: a comparison of electron-donor strengths. The journal of physical chemistry. A 20051020
Properties