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Home > Nitro Compounds > 200933-26-2

200933-26-2

200933-26-2 | Hydrazinecarbothioamide, 2-[(3-nitro-2-pyridinyl)methylene]-, (2E)-

CAS No: 200933-26-2 Catalog No: AG002D3U MDL No:MFCD22420461

Product Description

Catalog Number:
AG002D3U
Chemical Name:
Hydrazinecarbothioamide, 2-[(3-nitro-2-pyridinyl)methylene]-, (2E)-
CAS Number:
200933-26-2
Molecular Formula:
C7H7N5O2S
Molecular Weight:
225.2278
MDL Number:
MFCD22420461
IUPAC Name:
[(E)-(3-nitropyridin-2-yl)methylideneamino]thiourea
InChI:
InChI=1S/C7H7N5O2S/c8-7(15)11-10-4-5-6(12(13)14)2-1-3-9-5/h1-4H,(H3,8,11,15)/b10-4+
InChI Key:
PERKXAPWDKXLAU-ONNFQVAWSA-N
SMILES:
NC(=S)N/N=C/c1ncccc1[N+](=O)[O-]

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
225.032g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.226g/mol
Monoisotopic Mass:
225.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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