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89543-80-6 | 3-Cyclohexene-1-carboxaldehyde, 6-propyl-
CAS No: 89543-80-6 Catalog No: AG0040H4 MDL No:
Product Description
Catalog Number:
AG0040H4
Chemical Name:
3-Cyclohexene-1-carboxaldehyde, 6-propyl-
CAS Number:
89543-80-6
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
6-propylcyclohex-3-ene-1-carbaldehyde
InChI:
InChI=1S/C10H16O/c1-2-5-9-6-3-4-7-10(9)8-11/h3-4,8-10H,2,5-7H2,1H3
InChI Key:
LCUPTDQQRQEAKQ-UHFFFAOYSA-N
SMILES:
CCCC1CC=CCC1C=O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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