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820222-43-3 | [1,1'-Bicyclobutyl]-1-ol, 1',2,2-trimethyl-
CAS No: 820222-43-3 Catalog No: AG0053OU MDL No:
Product Description
Catalog Number:
AG0053OU
Chemical Name:
[1,1'-Bicyclobutyl]-1-ol, 1',2,2-trimethyl-
CAS Number:
820222-43-3
Molecular Formula:
C11H20O
Molecular Weight:
168.2759
IUPAC Name:
2,2-dimethyl-1-(1-methylcyclobutyl)cyclobutan-1-ol
InChI:
InChI=1S/C11H20O/c1-9(2)7-8-11(9,12)10(3)5-4-6-10/h12H,4-8H2,1-3H3
InChI Key:
CDTVMRXMYZLTTE-UHFFFAOYSA-N
SMILES:
OC1(CCC1(C)C)C1(C)CCC1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.151g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.28g/mol
Monoisotopic Mass:
168.151g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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