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10181-59-6 | Cyclobutanone, 2,2,4,4-tetramethyl-3-thioxo-
CAS No: 10181-59-6 Catalog No: AG0005ME MDL No:MFCD16876707
Product Description
Catalog Number:
AG0005ME
Chemical Name:
Cyclobutanone, 2,2,4,4-tetramethyl-3-thioxo-
CAS Number:
10181-59-6
Molecular Formula:
C8H12OS
Molecular Weight:
156.2453
MDL Number:
MFCD16876707
IUPAC Name:
2,2,4,4-tetramethyl-3-sulfanylidenecyclobutan-1-one
InChI:
InChI=1S/C8H12OS/c1-7(2)5(9)8(3,4)6(7)10/h1-4H3
InChI Key:
SVRXPTCPQFXZSF-UHFFFAOYSA-N
SMILES:
O=C1C(C)(C)C(=S)C1(C)C
NSC Number:
650981
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.061g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.243g/mol
Monoisotopic Mass:
156.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Relative reactivities of carbonyl and thiocarbonyl groups toward dimethoxycarbene: two new dimethoxythiiranes. | Chemistry (Weinheim an der Bergstrasse, Germany) 20020503 |
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