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102570-35-4 | Cyclobutanethione, 2,2,4,4-tetramethyl-3-(phenylimino)-
CAS No: 102570-35-4 Catalog No: AG0007QX MDL No:
Product Description
Catalog Number:
AG0007QX
Chemical Name:
Cyclobutanethione, 2,2,4,4-tetramethyl-3-(phenylimino)-
CAS Number:
102570-35-4
Molecular Formula:
C14H17NS
Molecular Weight:
231.3565
IUPAC Name:
2,2,4,4-tetramethyl-3-phenyliminocyclobutane-1-thione
InChI:
InChI=1S/C14H17NS/c1-13(2)11(14(3,4)12(13)16)15-10-8-6-5-7-9-10/h5-9H,1-4H3
InChI Key:
IEGVRHDASDYWPU-UHFFFAOYSA-N
SMILES:
S=C1C(C)(C)C(=Nc2ccccc2)C1(C)C
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.357g/mol
Monoisotopic Mass:
231.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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