Home Aldehydes 3-phenylcyclohexanecarbaldehyde

3-phenylcyclohexanecarbaldehyde

CAS No.:
13082-55-8
Catalog Number:
AG01DV80
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
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Product Description
Catalog Number:
AG01DV80
Chemical Name:
3-phenylcyclohexanecarbaldehyde
CAS Number:
13082-55-8
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
MDL Number:
MFCD24679867
IUPAC Name:
3-phenylcyclohexane-1-carbaldehyde
InChI:
InChI=1S/C13H16O/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-3,6-7,10-11,13H,4-5,8-9H2
InChI Key:
MTCVTKTXZNKYAE-UHFFFAOYSA-N
SMILES:
O=CC1CCCC(C1)c1ccccc1
Properties
Complexity:
182  
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:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties