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Home > Other Heterocycles > 17687-75-1
17687-75-1 | Bicyclo[2.2.1]heptane-2-methanol, α,α-bis(bicyclo[2.2.1]hept-2-yl)-
CAS No: 17687-75-1 Catalog No: AG0024YD MDL No:
Product Description
Catalog Number:
AG0024YD
Chemical Name:
Bicyclo[2.2.1]heptane-2-methanol, α,α-bis(bicyclo[2.2.1]hept-2-yl)-
CAS Number:
17687-75-1
Molecular Formula:
C22H34O
Molecular Weight:
314.5048
IUPAC Name:
tris(2-bicyclo[2.2.1]heptanyl)methanol
InChI:
InChI=1S/C22H34O/c23-22(19-10-13-1-4-16(19)7-13,20-11-14-2-5-17(20)8-14)21-12-15-3-6-18(21)9-15/h13-21,23H,1-12H2
InChI Key:
JNDULIIEHFWRQA-UHFFFAOYSA-N
SMILES:
OC(C1CC2CC1CC2)(C1CC2CC1CC2)C1CC2CC1CC2
NSC Number:
146244
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.261g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.513g/mol
Monoisotopic Mass:
314.261g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
9
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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