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1845-44-9 | 2-(isopropyl)-5-methylcyclohexanecarbaldehyde
CAS No: 1845-44-9 Catalog No: AG00B3W2 MDL No:
Product Description
Catalog Number:
AG00B3W2
Chemical Name:
2-(isopropyl)-5-methylcyclohexanecarbaldehyde
CAS Number:
1845-44-9
IUPAC Name:
5-methyl-2-propan-2-ylcyclohexane-1-carbaldehyde
InChI:
InChI=1S/C11H20O/c1-8(2)11-5-4-9(3)6-10(11)7-12/h7-11H,4-6H2,1-3H3
InChI Key:
AUABNXZOGNPUSY-UHFFFAOYSA-N
EC Number:
217-424-9
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.151g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.28g/mol
Monoisotopic Mass:
168.151g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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