4,4-dicyclopropylbut-3-en-1-ol

C10H16O — CID 19828616

IUPAC4,4-dicyclopropylbut-3-en-1-ol
SMILESOCCC=C(C1CC1)C1CC1
InChIInChI=1S/C10H16O/c11-7-1-2-10(8-3-4-8)9-5-6-9/h2,8-9,11H,1,3-7H2
InChIKeyIFSDRBGMBLYYAF-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.12
Rot. Bonds4

About 4,4-dicyclopropylbut-3-en-1-ol

4,4-dicyclopropylbut-3-en-1-ol (PubChem CID 19828616) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 4,4-dicyclopropylbut-3-en-1-ol.

Molecular Properties

Compound Name4,4-dicyclopropylbut-3-en-1-ol
PubChem CID19828616
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name4,4-dicyclopropylbut-3-en-1-ol
SMILESOCCC=C(C1CC1)C1CC1
InChIInChI=1S/C10H16O/c11-7-1-2-10(8-3-4-8)9-5-6-9/h2,8-9,11H,1,3-7H2
InChIKeyIFSDRBGMBLYYAF-UHFFFAOYSA-N
XLogP2.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(E)-hex-2-en-2-yl]cyclopropane
CID 23063598
4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol
CID 141072795
4,4-difluorobut-3-en-1-ol
CID 14855882
(3E,7E)-4,8-dimethyldeca-3,7-dien-1-ol
CID 22749874
(E)-1-cyclohexylpent-1-en-1-ol
CID 142446276
1-cyclopropylbuta-1,3-dienylcyclopropane
CID 12578306
1-cyclopropyl-3-hydroxypropan-1-one
CID 115011064
2-(3-hydroxypropylidene)propanedial
CID 141350211
[(Z)-1-fluoronon-1-enyl]cyclopropane
CID 44549689
(Z)-3-methylhex-3-ene-1,6-diol
CID 129322397
hex-3-en-1-ol;propanoic acid
CID 71381024
5-hydroxy-2-methylpent-2-enoic acid;2-methylidenebutanoic acid
CID 173207382

Frequently Asked Questions

What is the IUPAC name of 4,4-dicyclopropylbut-3-en-1-ol?
The IUPAC name of 4,4-dicyclopropylbut-3-en-1-ol (CID 19828616) is 4,4-dicyclopropylbut-3-en-1-ol.
What is the SMILES notation for 4,4-dicyclopropylbut-3-en-1-ol?
The canonical SMILES for 4,4-dicyclopropylbut-3-en-1-ol is OCCC=C(C1CC1)C1CC1.
What is the InChIKey of 4,4-dicyclopropylbut-3-en-1-ol?
The InChIKey is IFSDRBGMBLYYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c11-7-1-2-10(8-3-4-8)9-5-6-9/h2,8-9,11H,1,3-7H2.
What are the key properties of 4,4-dicyclopropylbut-3-en-1-ol?
4,4-dicyclopropylbut-3-en-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dicyclopropylbut-3-en-1-ol is sourced from PubChem (CID 19828616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).