Home Aldehydes 4-fluorocyclohexanecarbaldehyde, Mixture of isomers

4-fluorocyclohexanecarbaldehyde, Mixture of isomers

CAS No.:
1554041-53-0
Catalog Number:
AG01BTX2
Molecular Formula:
C7H11FO
Molecular Weight:
130.1600
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Product Description
Catalog Number:
AG01BTX2
Chemical Name:
4-fluorocyclohexanecarbaldehyde, Mixture of isomers
CAS Number:
1554041-53-0
Molecular Formula:
C7H11FO
Molecular Weight:
130.1600
MDL Number:
MFCD26727963
IUPAC Name:
4-fluorocyclohexane-1-carbaldehyde
InChI:
InChI=1S/C7H11FO/c8-7-3-1-6(5-9)2-4-7/h5-7H,1-4H2
InChI Key:
OQRSBWCLDGFKRY-UHFFFAOYSA-N
SMILES:
O=CC1CCC(CC1)F
Properties
Complexity:
95.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.162g/mol
Monoisotopic Mass:
130.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties