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84559-99-9 | 2-Cyclohexene-1-carboxaldehyde,3,5,5-trimethyl-
CAS No: 84559-99-9 Catalog No: AG004UQA MDL No:
Product Description
Catalog Number:
AG004UQA
Chemical Name:
2-Cyclohexene-1-carboxaldehyde,3,5,5-trimethyl-
CAS Number:
84559-99-9
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
3,5,5-trimethylcyclohex-2-ene-1-carbaldehyde
InChI:
InChI=1S/C10H16O/c1-8-4-9(7-11)6-10(2,3)5-8/h4,7,9H,5-6H2,1-3H3
InChI Key:
YONAHFYUNJWCOX-UHFFFAOYSA-N
SMILES:
O=CC1C=C(C)CC(C1)(C)C
EC Number:
283-186-8
Properties
Complexity:
189
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:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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