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178369-94-3 | 1,2,5-Thiadiazole, 3-chloro-4-(hexyloxy)-
CAS No: 178369-94-3 Catalog No: AG0025YR MDL No:
Product Description
Catalog Number:
AG0025YR
Chemical Name:
1,2,5-Thiadiazole, 3-chloro-4-(hexyloxy)-
CAS Number:
178369-94-3
Molecular Formula:
C8H13ClN2OS
Molecular Weight:
220.7196
IUPAC Name:
3-chloro-4-hexoxy-1,2,5-thiadiazole
InChI:
InChI=1S/C8H13ClN2OS/c1-2-3-4-5-6-12-8-7(9)10-13-11-8/h2-6H2,1H3
InChI Key:
PGNAJARFFVITCJ-UHFFFAOYSA-N
SMILES:
CCCCCCOc1nsnc1Cl
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.044g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.715g/mol
Monoisotopic Mass:
220.044g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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