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Home > Other Heterocycles > 2574-42-7
2574-42-7 | Bicyclo[2.2.2]octane-1-methanol
CAS No: 2574-42-7 Catalog No: AG00IL91 MDL No:
Product Description
Catalog Number:
AG00IL91
Chemical Name:
Bicyclo[2.2.2]octane-1-methanol
CAS Number:
2574-42-7
Molecular Formula:
C9H16O
Molecular Weight:
140.2227
IUPAC Name:
1-bicyclo[2.2.2]octanylmethanol
InChI:
InChI=1S/C9H16O/c10-7-9-4-1-8(2-5-9)3-6-9/h8,10H,1-7H2
InChI Key:
HNFOXZBCUXJBJM-UHFFFAOYSA-N
SMILES:
OCC12CCC(CC1)CC2
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.12g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.226g/mol
Monoisotopic Mass:
140.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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