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94777-00-1

94777-00-1 | Cyanamide, [3-(phenylmethyl)-2-thiazolidinylidene]-

CAS No: 94777-00-1 Catalog No: AG006SBB MDL No:

Product Description

Catalog Number:
AG006SBB
Chemical Name:
Cyanamide, [3-(phenylmethyl)-2-thiazolidinylidene]-
CAS Number:
94777-00-1
Molecular Formula:
C11H11N3S
Molecular Weight:
217.2901
IUPAC Name:
(3-benzyl-1,3-thiazolidin-2-ylidene)cyanamide
InChI:
InChI=1S/C11H11N3S/c12-9-13-11-14(6-7-15-11)8-10-4-2-1-3-5-10/h1-5H,6-8H2
InChI Key:
GGMDHDPZNBJHPO-UHFFFAOYSA-N
SMILES:
N#CN=C1SCCN1Cc1ccccc1

Properties

Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.067g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.29g/mol
Monoisotopic Mass:
217.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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