3,3-difluoro-2-methoxypent-1-ene

C6H10F2O — CID 143721934

IUPAC3,3-difluoro-2-methoxypent-1-ene
SMILESC=C(OC)C(F)(F)CC
InChIInChI=1S/C6H10F2O/c1-4-6(7,8)5(2)9-3/h2,4H2,1,3H3
InChIKeyHGCWHJWBANOXIF-UHFFFAOYSA-N
MW136.14 g/mol
LogP2.19
Rot. Bonds3

About 3,3-difluoro-2-methoxypent-1-ene

3,3-difluoro-2-methoxypent-1-ene (PubChem CID 143721934) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is 3,3-difluoro-2-methoxypent-1-ene.

Molecular Properties

Compound Name3,3-difluoro-2-methoxypent-1-ene
PubChem CID143721934
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name3,3-difluoro-2-methoxypent-1-ene
SMILESC=C(OC)C(F)(F)CC
InChIInChI=1S/C6H10F2O/c1-4-6(7,8)5(2)9-3/h2,4H2,1,3H3
InChIKeyHGCWHJWBANOXIF-UHFFFAOYSA-N
XLogP2.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-2-methoxypent-1-en-3-ol
CID 89149604
3,3-difluoro-3-iodo-2-methoxyprop-1-ene
CID 153132696
2-ethenoxypent-1-ene-3,3-diol
CID 141053305
(3E)-4-methoxy-5-methylidenehepta-1,3-diene
CID 169163685
tert-butyl 2-ethyl-5-methoxy-2,4,4-trimethylhex-5-enoate
CID 89223123
3-methyl-2-[(2-methylpropan-2-yl)oxy]-3-(trifluoromethyl)pent-1-ene
CID 87159470
3-chloro-2-methoxy-3-methylbut-1-ene
CID 144521086
5,5-difluoro-2-methylhept-1-ene
CID 154971061
(Z)-1,1,1,2,3,4,4-heptafluorohex-2-ene
CID 124671886
2,2-difluorobutanoyl chloride
CID 105428401
2-methoxypenta-1,4-diene
CID 12625760
3-(2-methylprop-2-enoyloxy)propyl 2,2-difluorobutanoate
CID 88573524

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-2-methoxypent-1-ene?
The IUPAC name of 3,3-difluoro-2-methoxypent-1-ene (CID 143721934) is 3,3-difluoro-2-methoxypent-1-ene.
What is the SMILES notation for 3,3-difluoro-2-methoxypent-1-ene?
The canonical SMILES for 3,3-difluoro-2-methoxypent-1-ene is C=C(OC)C(F)(F)CC.
What is the InChIKey of 3,3-difluoro-2-methoxypent-1-ene?
The InChIKey is HGCWHJWBANOXIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O/c1-4-6(7,8)5(2)9-3/h2,4H2,1,3H3.
What are the key properties of 3,3-difluoro-2-methoxypent-1-ene?
3,3-difluoro-2-methoxypent-1-ene has a molecular weight of 136.14 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-2-methoxypent-1-ene is sourced from PubChem (CID 143721934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).