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17229-76-4 | 2-Propylbenzo[d]thiazole
CAS No: 17229-76-4 Catalog No: AG003HWQ MDL No:MFCD15146801
Product Description
Catalog Number:
AG003HWQ
Chemical Name:
2-Propylbenzo[d]thiazole
CAS Number:
17229-76-4
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
MDL Number:
MFCD15146801
IUPAC Name:
2-propyl-1,3-benzothiazole
InChI:
InChI=1S/C10H11NS/c1-2-5-10-11-8-6-3-4-7-9(8)12-10/h3-4,6-7H,2,5H2,1H3
InChI Key:
ZVTBXGSHAYDNOP-UHFFFAOYSA-N
SMILES:
CCCc1nc2c(s1)cccc2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.265g/mol
Monoisotopic Mass:
177.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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