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Home > Other Heterocycles > 95455-32-6
95455-32-6 | 7-Oxabicyclo[2.2.1]heptane, 1-(dimethoxymethyl)-2,3-bis(methylene)-
CAS No: 95455-32-6 Catalog No: AG006DDQ MDL No:
Product Description
Catalog Number:
AG006DDQ
Chemical Name:
7-Oxabicyclo[2.2.1]heptane, 1-(dimethoxymethyl)-2,3-bis(methylene)-
CAS Number:
95455-32-6
Molecular Formula:
C11H16O3
Molecular Weight:
196.2429
IUPAC Name:
1-(dimethoxymethyl)-2,3-dimethylidene-7-oxabicyclo[2.2.1]heptane
InChI:
InChI=1S/C11H16O3/c1-7-8(2)11(10(12-3)13-4)6-5-9(7)14-11/h9-10H,1-2,5-6H2,3-4H3
InChI Key:
NQPZGEWBYRWJOP-UHFFFAOYSA-N
SMILES:
COC(C12CCC(O1)C(=C)C2=C)OC
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.246g/mol
Monoisotopic Mass:
196.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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