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113836-51-4 | 1,3,4-Thiadiazol-2-amine, 5-nonyl-
CAS No: 113836-51-4 Catalog No: AG0009UC MDL No:
Product Description
Catalog Number:
AG0009UC
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-nonyl-
CAS Number:
113836-51-4
Molecular Formula:
C11H21N3S
Molecular Weight:
227.3695
IUPAC Name:
5-nonyl-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C11H21N3S/c1-2-3-4-5-6-7-8-9-10-13-14-11(12)15-10/h2-9H2,1H3,(H2,12,14)
InChI Key:
UXGCJGDBDKTWID-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1nnc(s1)N
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.146g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.37g/mol
Monoisotopic Mass:
227.146g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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