Home Other Building Blocks 1,4-BUTANE DIISOTHIOCYANATE

1,4-BUTANE DIISOTHIOCYANATE

CAS No.:
4430-51-7
Catalog Number:
AG003DN6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003DN6
Chemical Name:
1,4-BUTANE DIISOTHIOCYANATE
CAS Number:
4430-51-7
MDL Number:
MFCD00041136
IUPAC Name:
1,4-diisothiocyanatobutane
InChI:
InChI=1S/C6H8N2S2/c9-5-7-3-1-2-4-8-6-10/h1-4H2
InChI Key:
RRSISCMPUAGVJN-UHFFFAOYSA-N
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.013g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.264g/mol
Monoisotopic Mass:
172.013g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties