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Home > Other Heterocycles > 90410-23-4
90410-23-4 | bicyclo[5.1.0]octan-4-ol
CAS No: 90410-23-4 Catalog No: AG01BU4D MDL No:MFCD30095417
Product Description
Catalog Number:
AG01BU4D
Chemical Name:
bicyclo[5.1.0]octan-4-ol
CAS Number:
90410-23-4
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
MDL Number:
MFCD30095417
IUPAC Name:
bicyclo[5.1.0]octan-4-ol
InChI:
InChI=1S/C8H14O/c9-8-3-1-6-5-7(6)2-4-8/h6-9H,1-5H2
InChI Key:
DTRKIOSKHMKYSU-UHFFFAOYSA-N
SMILES:
OC1CCC2C(CC1)C2
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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