cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde

C10H16O — CID 102109585

IUPACcis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde
SMILESC=C(C)[C@@H]1CCCC[C@H]1C=O
InChIInChI=1S/C10H16O/c1-8(2)10-6-4-3-5-9(10)7-11/h7,9-10H,1,3-6H2,2H3/t9-,10-/m0/s1
InChIKeyZRRBLAIBNWUXHE-UWVGGRQHSA-N
MW152.24 g/mol
LogP2.57
Rot. Bonds2

About cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde

cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde (PubChem CID 102109585) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde.

Molecular Properties

Compound Namecis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde
PubChem CID102109585
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Namecis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde
SMILESC=C(C)[C@@H]1CCCC[C@H]1C=O
InChIInChI=1S/C10H16O/c1-8(2)10-6-4-3-5-9(10)7-11/h7,9-10H,1,3-6H2,2H3/t9-,10-/m0/s1
InChIKeyZRRBLAIBNWUXHE-UWVGGRQHSA-N
XLogP2.57
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

trans-methyl (1S,2R)-2-formylcyclohexane-1-carboxylate
CID 11126697
trans-(1S,2S)-1-methyl-2-prop-1-en-2-ylcyclohexane
CID 163550244
5-prop-1-en-2-ylbicyclo[2.2.1]heptane-2-carbaldehyde
CID 71327451
trans-(1R,5R)-2,2-dimethyl-5-prop-1-en-2-ylcyclopentane-1-carbaldehyde
CID 131160822
2-prop-1-en-2-ylcyclododecan-1-ol
CID 141054945
2-prop-1-en-2-ylbicyclo[9.7.0]octadecane
CID 123413845
cis-(1R,2R)-2-prop-1-en-2-ylcyclopentan-1-ol
CID 12033954
methoxymethane;(2S)-2-methylcyclohexane-1-carbaldehyde
CID 142164429
2-benzoylcyclohexane-1-carbaldehyde
CID 174762479
cis-(1R,2S)-2-[(1E)-3-methylbuta-1,3-dienyl]cyclohexan-1-ol
CID 101161499
(1S)-2-[(Z)-prop-1-enyl]cyclohexane-1-carbaldehyde
CID 173500000
2-(methylamino)cyclohexane-1-carbaldehyde
CID 22969368

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde?
The IUPAC name of cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde (CID 102109585) is cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde.
What is the SMILES notation for cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde?
The canonical SMILES for cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde is C=C(C)[C@@H]1CCCC[C@H]1C=O.
What is the InChIKey of cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde?
The InChIKey is ZRRBLAIBNWUXHE-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H16O/c1-8(2)10-6-4-3-5-9(10)7-11/h7,9-10H,1,3-6H2,2H3/t9-,10-/m0/s1.
What are the key properties of cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde?
cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde has a molecular weight of 152.24 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-prop-1-en-2-ylcyclohexane-1-carbaldehyde is sourced from PubChem (CID 102109585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).