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16434-32-5 | Hydrazinecarbothioamide, 2-[(5-bromo-2-hydroxyphenyl)methylene]-
CAS No: 16434-32-5 Catalog No: AG001UTY MDL No:
Product Description
Catalog Number:
AG001UTY
Chemical Name:
Hydrazinecarbothioamide, 2-[(5-bromo-2-hydroxyphenyl)methylene]-
CAS Number:
16434-32-5
Molecular Formula:
C8H8BrN3OS
Molecular Weight:
274.1376
IUPAC Name:
[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]thiourea
InChI:
InChI=1S/C8H8BrN3OS/c9-6-1-2-7(13)5(3-6)4-11-12-8(10)14/h1-4,13H,(H3,10,12,14)/b11-4+
InChI Key:
AMZRNDJCSNFEHY-NYYWCZLTSA-N
SMILES:
NC(=S)NN=Cc1cc(Br)ccc1O
NSC Number:
110692
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
272.957g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
274.136g/mol
Monoisotopic Mass:
272.957g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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