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Home > Other Heterocycles > 116316-71-3
116316-71-3 | Trispiro[2.0.2.1.2.2]dodecane (9CI)
CAS No: 116316-71-3 Catalog No: AG000C6P MDL No:
Product Description
Catalog Number:
AG000C6P
Chemical Name:
Trispiro[2.0.2.1.2.2]dodecane (9CI)
CAS Number:
116316-71-3
Molecular Formula:
C13H22
Molecular Weight:
178.3138
IUPAC Name:
7,7-dimethyldispiro[2.0.54.23]undecane
InChI:
InChI=1S/C13H22/c1-11(2)3-5-12(6-4-11)7-8-13(12)9-10-13/h3-10H2,1-2H3
InChI Key:
XILFIHGIWCRDMR-UHFFFAOYSA-N
SMILES:
CC1(C)CCC2(CC1)CCC12CC1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.172g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.319g/mol
Monoisotopic Mass:
178.172g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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