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90993-47-8

90993-47-8 | (5-NITROTHIOPHEN-2-YL)METHANAMINE

CAS No: 90993-47-8 Catalog No: AG006FRV MDL No:MFCD06212721

Product Description

Catalog Number:
AG006FRV
Chemical Name:
(5-NITROTHIOPHEN-2-YL)METHANAMINE
CAS Number:
90993-47-8
Molecular Formula:
C5H6N2O2S
Molecular Weight:
158.1783
MDL Number:
MFCD06212721
IUPAC Name:
(5-nitrothiophen-2-yl)methanamine
InChI:
InChI=1S/C5H6N2O2S/c6-3-4-1-2-5(10-4)7(8)9/h1-2H,3,6H2
InChI Key:
GIUPGSUAELRKOZ-UHFFFAOYSA-N
SMILES:
NCc1ccc(s1)[N+](=O)[O-]

Properties

Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.015g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.175g/mol
Monoisotopic Mass:
158.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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