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10-Fluoro-capric acid

HCID 9542
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
334-59-8
Standard SMILES
O=C(O)CCCCCCCCCF
InChIKey
LXJHQFGNWFLQTR-UHFFFAOYSA-N
Molecular formula
C10H19FO2
Average molar mass
190.25 g/mol
Monoisotopic mass
190.13690801

Overview

10-fluoro-capric acid is a medium-chain fatty acid and a fluoro fatty acid.

Names & identifiers

Preferred name
10-Fluoro-capric acid
IUPAC
10-fluorodecanoic acid
English name
10-Fluorodecanoic acid
Molecular formula
C10H19FO2
Molecular weight
190.26

Names & synonyms

10-fluoro-capric acid10-fluoro-decanoic acidRefChem:105722110-Fluorodecanoic acid334-59-8DECANOIC ACID, 10-FLUORO-MFCD0173602810:0(10F)omega-Fluorodecanoic acidKyselina 10-fluordekanova [Czech]Kyselina 10-fluordekanovaBRN 1765020
Show more names
10-Fluorocapric acid4-bromo-2,5-dimethoxybenzene-5-sulfonylchloride
MFCAs n=9SCHEMBL434540C10H19FO2DTXSID90187036CHEBI:137794LMFA01090047BS-48903E75273

Database identifiers

CAS
334-59-8
PubChem CID
9542
DTXSID
DTXSID90187036
ChEBI
CHEBI:137794
Nikkaji
J40.815H

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
13
Formal charge
0
Complexity
126

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Halogenated fatty acids [FA0109]

Physicochemical properties

Melting point
49 °C · 49°C
Boiling point
90 · 90-95 °C(Press: 0.1 Torr)
Density
0.9651 · 0.9651 (estimate)
pka
4.78 · 4.78±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Upstream raw materials

BRN 177147310-Fluoro-1-decanolMETHYL 10-HYDROXYDECANOATE

Suppliers6 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
沈阳莫德医药科技有限公司024-23982345 · [email protected]

Additional notes

DefinitionChEBI: 10-fluoro-capric acid is a medium-chain fatty acid and a fluoro fatty acid.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes