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Home > Other Heterocycles > 1985-75-7
1985-75-7 | 7-Oxabicyclo[4.1.0]heptane, 4-methyl-3,3'-(oxydimethylene)bis- (7CI,8CI)
CAS No: 1985-75-7 Catalog No: AG002BKP MDL No:
Product Description
Catalog Number:
AG002BKP
Chemical Name:
7-Oxabicyclo[4.1.0]heptane, 4-methyl-3,3'-(oxydimethylene)bis- (7CI,8CI)
CAS Number:
1985-75-7
Molecular Formula:
C15H24O3
Molecular Weight:
252.3493
IUPAC Name:
3-methyl-4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethyl)-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C15H24O3/c1-9-4-13-15(18-13)6-11(9)8-16-7-10-2-3-12-14(5-10)17-12/h9-15H,2-8H2,1H3
InChI Key:
WQMIMIXFXIXJCD-UHFFFAOYSA-N
SMILES:
CC1CC2OC2CC1COCC1CCC2C(C1)O2
NSC Number:
36648
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.354g/mol
Monoisotopic Mass:
252.173g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.3A^2
Undefined Atom Stereocenter Count:
7
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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