Home Other Building Blocks imino(methyl)(2-methylfuran-3-yl)-lambda6-sulfanone

imino(methyl)(2-methylfuran-3-yl)-lambda6-sulfanone

CAS No.:
2060057-13-6
Catalog Number:
AG01BVDA
Molecular Formula:
C6H9NO2S
Molecular Weight:
159.2062
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Product Description
Catalog Number:
AG01BVDA
Chemical Name:
imino(methyl)(2-methylfuran-3-yl)-lambda6-sulfanone
CAS Number:
2060057-13-6
Molecular Formula:
C6H9NO2S
Molecular Weight:
159.2062
MDL Number:
MFCD30345505
IUPAC Name:
imino-methyl-(2-methylfuran-3-yl)-oxo-λ6-sulfane
InChI:
InChI=1S/C6H9NO2S/c1-5-6(3-4-9-5)10(2,7)8/h3-4,7H,1-2H3
InChI Key:
DOCNAESLZRGJHL-UHFFFAOYSA-N
SMILES:
Cc1occc1S(=O)(=N)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.035g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
159.203g/mol
Monoisotopic Mass:
159.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties