Home Other Building Blocks N-cyclopropyl-2-isothiocyanatoacetamide

N-cyclopropyl-2-isothiocyanatoacetamide

CAS No.:
1154551-45-7
Catalog Number:
AG01AA8G
Molecular Formula:
C6H8N2OS
Molecular Weight:
156.2055
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Product Description
Catalog Number:
AG01AA8G
Chemical Name:
N-cyclopropyl-2-isothiocyanatoacetamide
CAS Number:
1154551-45-7
Molecular Formula:
C6H8N2OS
Molecular Weight:
156.2055
MDL Number:
MFCD12140335
IUPAC Name:
N-cyclopropyl-2-isothiocyanatoacetamide
InChI:
InChI=1S/C6H8N2OS/c9-6(3-7-4-10)8-5-1-2-5/h5H,1-3H2,(H,8,9)
InChI Key:
JNNSJVHXSSGKAO-UHFFFAOYSA-N
SMILES:
S=C=NCC(=O)NC1CC1
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.036g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.203g/mol
Monoisotopic Mass:
156.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties