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Home > Other Heterocycles > 145625-63-4
145625-63-4 | Spiro[1,3-benzodioxole-2,1'-cyclohexane], 4-(1-methylethyl)-
CAS No: 145625-63-4 Catalog No: AG001D82 MDL No:
Product Description
Catalog Number:
AG001D82
Chemical Name:
Spiro[1,3-benzodioxole-2,1'-cyclohexane], 4-(1-methylethyl)-
CAS Number:
145625-63-4
Molecular Formula:
C15H20O2
Molecular Weight:
232.3181
IUPAC Name:
4-propan-2-ylspiro[1,3-benzodioxole-2,1'-cyclohexane]
InChI:
InChI=1S/C15H20O2/c1-11(2)12-7-6-8-13-14(12)17-15(16-13)9-4-3-5-10-15/h6-8,11H,3-5,9-10H2,1-2H3
InChI Key:
QYUMZZUYPZANGK-UHFFFAOYSA-N
SMILES:
CC(c1cccc2c1OC1(O2)CCCCC1)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.146g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.323g/mol
Monoisotopic Mass:
232.146g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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