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88976-02-7 | Thiazole, 5-ethoxy-4,5-dihydro-2-phenoxy-
CAS No: 88976-02-7 Catalog No: AG004552 MDL No:
Product Description
Catalog Number:
AG004552
Chemical Name:
Thiazole, 5-ethoxy-4,5-dihydro-2-phenoxy-
CAS Number:
88976-02-7
Molecular Formula:
C11H13NO2S
Molecular Weight:
223.2914
IUPAC Name:
5-ethoxy-2-phenoxy-4,5-dihydro-1,3-thiazole
InChI:
InChI=1S/C11H13NO2S/c1-2-13-10-8-12-11(15-10)14-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChI Key:
XRLQRYLJHJYAQU-UHFFFAOYSA-N
SMILES:
CCOC1CN=C(S1)Oc1ccccc1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.29g/mol
Monoisotopic Mass:
223.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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