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122760-84-3 | Tricyclo[3.3.1.13,7]decan-2-ol, 4-methyl-8-methylene-
CAS No: 122760-84-3 Catalog No: AG000JEB MDL No:
Product Description
Catalog Number:
AG000JEB
Chemical Name:
Tricyclo[3.3.1.13,7]decan-2-ol, 4-methyl-8-methylene-
CAS Number:
122760-84-3
Molecular Formula:
C12H18O
Molecular Weight:
178.2707
IUPAC Name:
4-methyl-8-methylideneadamantan-2-ol
InChI:
InChI=1S/C12H18O/c1-6-8-3-9-5-10(6)12(13)11(4-8)7(9)2/h7-13H,1,3-5H2,2H3
InChI Key:
REINJUBMDBESCN-UHFFFAOYSA-N
SMILES:
CC1C2CC3CC1C(C(C2)C3=C)O
EC Number:
406-330-5
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.275g/mol
Monoisotopic Mass:
178.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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