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97759-75-6 | Oxazole, 4,5-dihydro-4,4-dimethyl-2-(3-methyl-2-thienyl)-
CAS No: 97759-75-6 Catalog No: AG00H7YD MDL No:
Product Description
Catalog Number:
AG00H7YD
Chemical Name:
Oxazole, 4,5-dihydro-4,4-dimethyl-2-(3-methyl-2-thienyl)-
CAS Number:
97759-75-6
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
IUPAC Name:
4,4-dimethyl-2-(3-methylthiophen-2-yl)-5H-1,3-oxazole
InChI:
InChI=1S/C10H13NOS/c1-7-4-5-13-8(7)9-11-10(2,3)6-12-9/h4-5H,6H2,1-3H3
InChI Key:
ZEMYSSZENXRKNR-UHFFFAOYSA-N
SMILES:
Cc1ccsc1C1=NC(CO1)(C)C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.28g/mol
Monoisotopic Mass:
195.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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