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188917-80-8 | 2,2':5',2''-Terthiophene, 5-decyl-
CAS No: 188917-80-8 Catalog No: AG002HIZ MDL No:
Product Description
Catalog Number:
AG002HIZ
Chemical Name:
2,2':5',2''-Terthiophene, 5-decyl-
CAS Number:
188917-80-8
Molecular Formula:
C22H28S3
Molecular Weight:
388.6527
IUPAC Name:
2-decyl-5-(5-thiophen-2-ylthiophen-2-yl)thiophene
InChI:
InChI=1S/C22H28S3/c1-2-3-4-5-6-7-8-9-11-18-13-14-21(24-18)22-16-15-20(25-22)19-12-10-17-23-19/h10,12-17H,2-9,11H2,1H3
InChI Key:
MQWGGPWFFVPNIH-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCc1ccc(s1)c1ccc(s1)c1cccs1
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.135g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.646g/mol
Monoisotopic Mass:
388.135g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.3
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