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Home > Other Heterocycles > 85204-19-9
85204-19-9 | Bicyclo[2.2.1]heptane-2-methanol,a-ethenyl-a,3,3-trimethyl-
CAS No: 85204-19-9 Catalog No: AG004QGJ MDL No:
Product Description
Catalog Number:
AG004QGJ
Chemical Name:
Bicyclo[2.2.1]heptane-2-methanol,a-ethenyl-a,3,3-trimethyl-
CAS Number:
85204-19-9
Molecular Formula:
C13H22O
Molecular Weight:
194.3132
IUPAC Name:
2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)but-3-en-2-ol
InChI:
InChI=1S/C13H22O/c1-5-13(4,14)11-9-6-7-10(8-9)12(11,2)3/h5,9-11,14H,1,6-8H2,2-4H3
InChI Key:
AVXCORVLTFVQGV-UHFFFAOYSA-N
SMILES:
C=CC(C1C2CCC(C1(C)C)C2)(O)C
EC Number:
286-314-0
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.318g/mol
Monoisotopic Mass:
194.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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