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138248-70-1 | Bicyclo[2.2.1]heptane-1-acetic acid, anhydride with bicyclo[2.2.1]heptane-1-acetic acid
CAS No: 138248-70-1 Catalog No: AG0018DN MDL No:
Product Description
Catalog Number:
AG0018DN
Chemical Name:
Bicyclo[2.2.1]heptane-1-acetic acid, anhydride with bicyclo[2.2.1]heptane-1-acetic acid
CAS Number:
138248-70-1
Molecular Formula:
C18H26O3
Molecular Weight:
290.3972
IUPAC Name:
[2-(1-bicyclo[2.2.1]heptanyl)acetyl] 2-(1-bicyclo[2.2.1]heptanyl)acetate
InChI:
InChI=1S/C18H26O3/c19-15(11-17-5-1-13(9-17)2-6-17)21-16(20)12-18-7-3-14(10-18)4-8-18/h13-14H,1-12H2
InChI Key:
FFYWKVZBTRHQPA-UHFFFAOYSA-N
SMILES:
O=C(CC12CCC(C2)CC1)OC(=O)CC12CCC(C2)CC1
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.188g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.403g/mol
Monoisotopic Mass:
290.188g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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