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Home > Aldehydes > 142457-17-8
142457-17-8 | 3-Cyclohexene-1-carboxaldehyde, 1,3-dimethyl-
CAS No: 142457-17-8 Catalog No: AG006YGO MDL No:
Product Description
Catalog Number:
AG006YGO
Chemical Name:
3-Cyclohexene-1-carboxaldehyde, 1,3-dimethyl-
CAS Number:
142457-17-8
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
1,3-dimethylcyclohex-3-ene-1-carbaldehyde
InChI:
InChI=1S/C9H14O/c1-8-4-3-5-9(2,6-8)7-10/h4,7H,3,5-6H2,1-2H3
InChI Key:
GBKFYIUZPUUNCX-UHFFFAOYSA-N
SMILES:
O=CC1(C)CCC=C(C1)C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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