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19684-46-9 | 1-(2-METHYLPROP-2-EN-1-YL)CYCLOHEXANE-1-CARBALDEHYDE
CAS No: 19684-46-9 Catalog No: AG01BIIQ MDL No:MFCD24676844
Product Description
Catalog Number:
AG01BIIQ
Chemical Name:
1-(2-METHYLPROP-2-EN-1-YL)CYCLOHEXANE-1-CARBALDEHYDE
CAS Number:
19684-46-9
Molecular Formula:
C11H18O
Molecular Weight:
166.2600
MDL Number:
MFCD24676844
IUPAC Name:
1-(2-methylprop-2-enyl)cyclohexane-1-carbaldehyde
InChI:
InChI=1S/C11H18O/c1-10(2)8-11(9-12)6-4-3-5-7-11/h9H,1,3-8H2,2H3
InChI Key:
PRPRSPTWYJHCKG-UHFFFAOYSA-N
SMILES:
O=CC1(CCCCC1)CC(=C)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.264g/mol
Monoisotopic Mass:
166.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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