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790662-04-3 | 2H-Pyran,6-[(1E)-1-ethoxy-3-methyl-1,3-butadien-1-yl]-3,4-dihydro-4,4-dimethyl-
CAS No: 790662-04-3 Catalog No: AG005CCF MDL No:
Product Description
Catalog Number:
AG005CCF
Chemical Name:
2H-Pyran,6-[(1E)-1-ethoxy-3-methyl-1,3-butadien-1-yl]-3,4-dihydro-4,4-dimethyl-
CAS Number:
790662-04-3
Molecular Formula:
C14H22O2
Molecular Weight:
222.3233
IUPAC Name:
6-(1-ethoxy-3-methylbuta-1,3-dienyl)-4,4-dimethyl-2,3-dihydropyran
InChI:
InChI=1S/C14H22O2/c1-6-15-12(9-11(2)3)13-10-14(4,5)7-8-16-13/h9-10H,2,6-8H2,1,3-5H3
InChI Key:
FMUKUKGFNHYONW-UHFFFAOYSA-N
SMILES:
CCO/C(=C/C(=C)C)/C1=CC(CCO1)(C)C
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.328g/mol
Monoisotopic Mass:
222.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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