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115654-96-1 | 2H-Pyran, tetrahydro-2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-
CAS No: 115654-96-1 Catalog No: AG000GPG MDL No:
Product Description
Catalog Number:
AG000GPG
Chemical Name:
2H-Pyran, tetrahydro-2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-
CAS Number:
115654-96-1
Molecular Formula:
C11H20O
Molecular Weight:
168.2759
IUPAC Name:
2,2-dimethyl-3-(2-methylprop-1-enyl)oxane
InChI:
InChI=1S/C11H20O/c1-9(2)8-10-6-5-7-12-11(10,3)4/h8,10H,5-7H2,1-4H3
InChI Key:
YEHLETFIUGVWRS-UHFFFAOYSA-N
SMILES:
CC(=CC1CCCOC1(C)C)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.151g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.28g/mol
Monoisotopic Mass:
168.151g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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