Home Aldehydes 1,4,4-trimethylcyclohexane-1-carbaldehyde

1,4,4-trimethylcyclohexane-1-carbaldehyde

CAS No.:
140423-42-3
Catalog Number:
AG01C219
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
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Product Description
Catalog Number:
AG01C219
Chemical Name:
1,4,4-trimethylcyclohexane-1-carbaldehyde
CAS Number:
140423-42-3
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
MDL Number:
MFCD24675795
IUPAC Name:
1,4,4-trimethylcyclohexane-1-carbaldehyde
InChI:
InChI=1S/C10H18O/c1-9(2)4-6-10(3,8-11)7-5-9/h8H,4-7H2,1-3H3
InChI Key:
HXVIIVYSWHVDGB-UHFFFAOYSA-N
SMILES:
O=CC1(C)CCC(CC1)(C)C
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties