Home Other Building Blocks 3-isothiocyanato-N,N-dimethylpropanamide

3-isothiocyanato-N,N-dimethylpropanamide

CAS No.:
1248198-30-2
Catalog Number:
AG01B1YJ
Molecular Formula:
C6H10N2OS
Molecular Weight:
158.2214
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Product Description
Catalog Number:
AG01B1YJ
Chemical Name:
3-isothiocyanato-N,N-dimethylpropanamide
CAS Number:
1248198-30-2
Molecular Formula:
C6H10N2OS
Molecular Weight:
158.2214
MDL Number:
MFCD16125995
IUPAC Name:
3-isothiocyanato-N,N-dimethylpropanamide
InChI:
InChI=1S/C6H10N2OS/c1-8(2)6(9)3-4-7-5-10/h3-4H2,1-2H3
InChI Key:
ZWWKEVYFKUZQLH-UHFFFAOYSA-N
SMILES:
S=C=NCCC(=O)N(C)C
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.051g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.219g/mol
Monoisotopic Mass:
158.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties