(Z,2R)-2-fluorodec-7-enal

C10H17FO — CID 134894209

IUPAC(Z,2R)-2-fluorodec-7-enal
SMILESCC/C=C\CCCC[C@@H](F)C=O
InChIInChI=1S/C10H17FO/c1-2-3-4-5-6-7-8-10(11)9-12/h3-4,9-10H,2,5-8H2,1H3/b4-3-/t10-/m1/s1
InChIKeyQPKDUHGIUATXQB-UMBAGQNISA-N
MW172.24 g/mol
LogP3.05
Rot. Bonds7

About (Z,2R)-2-fluorodec-7-enal

(Z,2R)-2-fluorodec-7-enal (PubChem CID 134894209) has the molecular formula C10H17FO and a molecular weight of 172.24 g/mol. Its IUPAC name is (Z,2R)-2-fluorodec-7-enal.

Molecular Properties

Compound Name(Z,2R)-2-fluorodec-7-enal
PubChem CID134894209
Molecular FormulaC10H17FO
Molecular Weight172.24 g/mol
Exact Mass172.13
IUPAC Name(Z,2R)-2-fluorodec-7-enal
SMILESCC/C=C\CCCC[C@@H](F)C=O
InChIInChI=1S/C10H17FO/c1-2-3-4-5-6-7-8-10(11)9-12/h3-4,9-10H,2,5-8H2,1H3/b4-3-/t10-/m1/s1
InChIKeyQPKDUHGIUATXQB-UMBAGQNISA-N
XLogP3.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.24
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-non-6-ene-1,1-diol
CID 170555028
acetic acid;2-fluorotetradec-11-en-1-ol
CID 71350090
(2S)-2-fluorohexadecanal
CID 134857256
10-methylundec-3-ene
CID 544769
(3E,16E)-nonadeca-3,16-diene
CID 157471321
(E)-heptadec-14-enal
CID 5367667
(E,2R)-dec-7-en-2-ol
CID 89151124
7,7-difluorohept-3-ene
CID 54444112
(E)-undec-8-en-2-ol
CID 118316981
(3Z,6Z,9Z,12Z,15Z)-21-methyldocosa-3,6,9,12,15-pentaene
CID 173133172
tetratriaconta-3,6,25,28-tetraen-16-yl formate
CID 91592372
(2E,10Z)-trideca-2,10-dienal
CID 129221038

Frequently Asked Questions

What is the IUPAC name of (Z,2R)-2-fluorodec-7-enal?
The IUPAC name of (Z,2R)-2-fluorodec-7-enal (CID 134894209) is (Z,2R)-2-fluorodec-7-enal.
What is the SMILES notation for (Z,2R)-2-fluorodec-7-enal?
The canonical SMILES for (Z,2R)-2-fluorodec-7-enal is CC/C=C\CCCC[C@@H](F)C=O.
What is the InChIKey of (Z,2R)-2-fluorodec-7-enal?
The InChIKey is QPKDUHGIUATXQB-UMBAGQNISA-N. The full InChI is InChI=1S/C10H17FO/c1-2-3-4-5-6-7-8-10(11)9-12/h3-4,9-10H,2,5-8H2,1H3/b4-3-/t10-/m1/s1.
What are the key properties of (Z,2R)-2-fluorodec-7-enal?
(Z,2R)-2-fluorodec-7-enal has a molecular weight of 172.24 g/mol, XLogP of 3.05, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2R)-2-fluorodec-7-enal is sourced from PubChem (CID 134894209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).