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1466-74-6 | Cyclohexanecarboxaldehyde, 4-phenyl-
CAS No: 1466-74-6 Catalog No: AG001E6K MDL No:MFCD06410876
Product Description
Catalog Number:
AG001E6K
Chemical Name:
Cyclohexanecarboxaldehyde, 4-phenyl-
CAS Number:
1466-74-6
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
MDL Number:
MFCD06410876
IUPAC Name:
4-phenylcyclohexane-1-carbaldehyde
InChI:
InChI=1S/C13H16O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-5,10-11,13H,6-9H2
InChI Key:
IMLXMWDBBUJWOV-UHFFFAOYSA-N
SMILES:
O=CC1CCC(CC1)c1ccccc1
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.27g/mol
Monoisotopic Mass:
188.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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