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142067-55-8 | 2H-Pyrrole, 2-(2,3-dihydro-2,5-dimethyl-2-furanyl)-2,5-dimethyl-
CAS No: 142067-55-8 Catalog No: AG001HOF MDL No:
Product Description
Catalog Number:
AG001HOF
Chemical Name:
2H-Pyrrole, 2-(2,3-dihydro-2,5-dimethyl-2-furanyl)-2,5-dimethyl-
CAS Number:
142067-55-8
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
IUPAC Name:
2-(2,5-dimethyl-3H-furan-2-yl)-2,5-dimethylpyrrole
InChI:
InChI=1S/C12H17NO/c1-9-5-7-11(3,13-9)12(4)8-6-10(2)14-12/h5-7H,8H2,1-4H3
InChI Key:
LYNKSEGNFDIHIA-UHFFFAOYSA-N
SMILES:
CC1=CCC(O1)(C)C1(C)C=CC(=N1)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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