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88070-27-3

88070-27-3 | Hydrazinecarbothioamide, 2-[(2-hydroxy-3,5-diiodophenyl)methylene]-

CAS No: 88070-27-3 Catalog No: AG004EU9 MDL No:

Product Description

Catalog Number:
AG004EU9
Chemical Name:
Hydrazinecarbothioamide, 2-[(2-hydroxy-3,5-diiodophenyl)methylene]-
CAS Number:
88070-27-3
Molecular Formula:
C8H7I2N3OS
Molecular Weight:
447.0346
IUPAC Name:
[(2-hydroxy-3,5-diiodophenyl)methylideneamino]thiourea
InChI:
InChI=1S/C8H7I2N3OS/c9-5-1-4(3-12-13-8(11)15)7(14)6(10)2-5/h1-3,14H,(H3,11,13,15)
InChI Key:
ZEKYSJFSZLLFHZ-UHFFFAOYSA-N
SMILES:
NC(=S)NN=Cc1cc(I)cc(c1O)I

Properties

Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.84g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
447.033g/mol
Monoisotopic Mass:
446.84g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.1  

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