Home Other Building Blocks tert-butyl(imino)methyl-lambda6-sulfanone

tert-butyl(imino)methyl-lambda6-sulfanone

CAS No.:
1085526-21-1
Catalog Number:
AG01B4XO
Molecular Formula:
C5H13NOS
Molecular Weight:
135.2278
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Product Description
Catalog Number:
AG01B4XO
Chemical Name:
tert-butyl(imino)methyl-lambda6-sulfanone
CAS Number:
1085526-21-1
Molecular Formula:
C5H13NOS
Molecular Weight:
135.2278
MDL Number:
MFCD30497495
IUPAC Name:
tert-butyl-imino-methyl-oxo-λ6-sulfane
InChI:
InChI=1S/C5H13NOS/c1-5(2,3)8(4,6)7/h6H,1-4H3
InChI Key:
ZJUMQDAODKLMFI-UHFFFAOYSA-N
SMILES:
CS(=O)(=N)C(C)(C)C
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.072g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
135.225g/mol
Monoisotopic Mass:
135.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties