Home Other Building Blocks [cyclopropyl(isothiocyanato)methyl]cyclopropane

[cyclopropyl(isothiocyanato)methyl]cyclopropane

CAS No.:
1247603-60-6
Catalog Number:
AG01AIWI
Molecular Formula:
C8H11NS
Molecular Weight:
153.2446
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Product Description
Catalog Number:
AG01AIWI
Chemical Name:
[cyclopropyl(isothiocyanato)methyl]cyclopropane
CAS Number:
1247603-60-6
Molecular Formula:
C8H11NS
Molecular Weight:
153.2446
MDL Number:
MFCD14676314
IUPAC Name:
[cyclopropyl(isothiocyanato)methyl]cyclopropane
InChI:
InChI=1S/C8H11NS/c10-5-9-8(6-1-2-6)7-3-4-7/h6-8H,1-4H2
InChI Key:
IYBYGPRXCBJXDA-UHFFFAOYSA-N
SMILES:
S=C=NC(C1CC1)C1CC1
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.243g/mol
Monoisotopic Mass:
153.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties