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14938-70-6 | Hydrazinecarbothioamide, 2-[(2-hydroxyphenyl)methylene]-N-phenyl-
CAS No: 14938-70-6 Catalog No: AG001LNS MDL No:
Product Description
Catalog Number:
AG001LNS
Chemical Name:
Hydrazinecarbothioamide, 2-[(2-hydroxyphenyl)methylene]-N-phenyl-
CAS Number:
14938-70-6
Molecular Formula:
C14H13N3OS
Molecular Weight:
271.3375
IUPAC Name:
1-[(E)-(2-hydroxyphenyl)methylideneamino]-3-phenylthiourea
InChI:
InChI=1S/C14H13N3OS/c18-13-9-5-4-6-11(13)10-15-17-14(19)16-12-7-2-1-3-8-12/h1-10,18H,(H2,16,17,19)/b15-10+
InChI Key:
BKJAPBJJTOJXEZ-XNTDXEJSSA-N
SMILES:
S=C(Nc1ccccc1)NN=Cc1ccccc1O
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
271.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
271.338g/mol
Monoisotopic Mass:
271.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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