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1269291-96-4 | Cyclobutanemethanol, 3-(1-methylethyl)-
CAS No: 1269291-96-4 Catalog No: AG000TIP MDL No:MFCD18801139
Product Description
Catalog Number:
AG000TIP
Chemical Name:
Cyclobutanemethanol, 3-(1-methylethyl)-
CAS Number:
1269291-96-4
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD18801139
IUPAC Name:
(3-propan-2-ylcyclobutyl)methanol
InChI:
InChI=1S/C8H16O/c1-6(2)8-3-7(4-8)5-9/h6-9H,3-5H2,1-2H3
InChI Key:
FVHPFGGDBCIDRZ-UHFFFAOYSA-N
SMILES:
OCC1CC(C1)C(C)C
Properties
Complexity:
82.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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