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14451-86-6 | Tricyclo[3.3.1.13,7]decan-2-ol, 2-butyl-
CAS No: 14451-86-6 Catalog No: AG001JOZ MDL No:
Product Description
Catalog Number:
AG001JOZ
Chemical Name:
Tricyclo[3.3.1.13,7]decan-2-ol, 2-butyl-
CAS Number:
14451-86-6
Molecular Formula:
C14H24O
Molecular Weight:
208.3398
IUPAC Name:
2-butyladamantan-2-ol
InChI:
InChI=1S/C14H24O/c1-2-3-4-14(15)12-6-10-5-11(8-12)9-13(14)7-10/h10-13,15H,2-9H2,1H3
InChI Key:
PXRAOOXXPGRCJZ-UHFFFAOYSA-N
SMILES:
CCCCC1(O)C2CC3CC1CC(C2)C3
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.183g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.345g/mol
Monoisotopic Mass:
208.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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