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Home > Other Heterocycles > 35765-54-9
35765-54-9 | 2,2'-Spirobi[tricyclo[3.3.1.13,7]decane]
CAS No: 35765-54-9 Catalog No: AG00798O MDL No:
Product Description
Catalog Number:
AG00798O
Chemical Name:
2,2'-Spirobi[tricyclo[3.3.1.13,7]decane]
CAS Number:
35765-54-9
Molecular Formula:
C19H28
Molecular Weight:
256.4256
IUPAC Name:
2,2'-spirobi[adamantane]
InChI:
InChI=1S/C19H28/c1-11-3-15-5-12(1)6-16(4-11)19(15)17-7-13-2-14(9-17)10-18(19)8-13/h11-18H,1-10H2
InChI Key:
QVBHKEIOVYOABS-UHFFFAOYSA-N
SMILES:
C1C2CC3C4(C1CC(C2)C3)C1CC2CC4CC(C1)C2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.219g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.433g/mol
Monoisotopic Mass:
256.219g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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