2-ethyl-1-hexylcyclopropan-1-ol

C11H22O — CID 85299282

IUPAC2-ethyl-1-hexylcyclopropan-1-ol
SMILESCCCCCCC1(O)CC1CC
InChIInChI=1S/C11H22O/c1-3-5-6-7-8-11(12)9-10(11)4-2/h10,12H,3-9H2,1-2H3
InChIKeyDQUFAPGGXIAAEL-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.12
Rot. Bonds6

About 2-ethyl-1-hexylcyclopropan-1-ol

2-ethyl-1-hexylcyclopropan-1-ol (PubChem CID 85299282) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-ethyl-1-hexylcyclopropan-1-ol.

Molecular Properties

Compound Name2-ethyl-1-hexylcyclopropan-1-ol
PubChem CID85299282
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name2-ethyl-1-hexylcyclopropan-1-ol
SMILESCCCCCCC1(O)CC1CC
InChIInChI=1S/C11H22O/c1-3-5-6-7-8-11(12)9-10(11)4-2/h10,12H,3-9H2,1-2H3
InChIKeyDQUFAPGGXIAAEL-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cis-(1S,2S)-1,2-dihexylcyclopropan-1-ol
CID 14921306
2-ethyl-1-nonylcyclohexan-1-ol
CID 65149326
cis-(1R,2S)-1-(2-chloroethyl)-2-ethylcyclopropan-1-ol
CID 15528876
2-ethyl-1-hexadecylcyclopropane-1-carboxylic acid
CID 57080968
2,4,4-trimethyl-1-octylcyclohexan-1-ol
CID 81315445
3-heptyl-2-methyloxolan-3-ol
CID 82718796
1-heptadecylcyclopropan-1-ol
CID 2802251
cis-(1R,2S)-2-methyl-2-nonylcyclopropan-1-ol
CID 102123339
1-(cyclopropylmethyl)-2-ethylcyclopropan-1-ol
CID 79333627
1-decyl-4-ethylcyclohexan-1-ol
CID 65147378
3-ethoxy-1-hexylcyclobutan-1-ol
CID 106823263
1-methyl-2-pentylcyclopropan-1-ol
CID 15701982

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-hexylcyclopropan-1-ol?
The IUPAC name of 2-ethyl-1-hexylcyclopropan-1-ol (CID 85299282) is 2-ethyl-1-hexylcyclopropan-1-ol.
What is the SMILES notation for 2-ethyl-1-hexylcyclopropan-1-ol?
The canonical SMILES for 2-ethyl-1-hexylcyclopropan-1-ol is CCCCCCC1(O)CC1CC.
What is the InChIKey of 2-ethyl-1-hexylcyclopropan-1-ol?
The InChIKey is DQUFAPGGXIAAEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-3-5-6-7-8-11(12)9-10(11)4-2/h10,12H,3-9H2,1-2H3.
What are the key properties of 2-ethyl-1-hexylcyclopropan-1-ol?
2-ethyl-1-hexylcyclopropan-1-ol has a molecular weight of 170.30 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-hexylcyclopropan-1-ol is sourced from PubChem (CID 85299282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).