Welcome to our website!

Product Catalog

Rapid Product Index

Recommended Products

Friend Links

  • 3-Thiophenamine,2-nitro
Name:3-Thiophenamine,2-nitro
CAS No:52003-20-0

PRODUCT DESCRIPTION

【Name】
3-Thiophenamine,2-nitro-
【Iupac name】
2-nitrothiophen-3-amine
【CAS Registry number】
52003-20-0
【Synonyms】
2-Nitro-3-aminothiophene
3-Amino-2-nitrothiophene
NSC 376708
【Molecular Formula】
C4H4 N2 O2 S (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C4H4N2O2S/c5-3-1-2-9-4(3)6(7)8/h1-2H,5H2
【Canonical SMILES】
C1=CSC(=C1N)[N+](=O)[O-]
【MOL File】
52003-20-0.mol

Chemical and Physical Properties

【Density】
1.549g/cm3
【Boiling Point】
360.2°Cat760mmHg
【Refractive Index】
1.686
【Flash Point】
171.6°C
【Computed Properties】
Molecular Weight:144.15176 [g/mol]
Molecular Formula:C4H4N2O2S
XLogP3-AA:1.6
H-Bond Donor:1
H-Bond Acceptor:4
Rotatable Bond Count:0
Exact Mass:143.999348
MonoIsotopic Mass:143.999348
Topological Polar Surface Area:100
Heavy Atom Count:9
Formal Charge:0
Complexity:124
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:1
Conformer Sampling RMSD:0.4
CID Conformer Count:1

RELATED PRODUCTS