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1-Fluoro-4-(3-iodopropyl)benzene

HCID 18364840
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
118156-84-6
Standard SMILES
Fc1ccc(CCCI)cc1
InChIKey
KZIWHIFUFXAERT-UHFFFAOYSA-N
Molecular formula
C9H10FI
Average molar mass
264.08 g/mol
Monoisotopic mass
263.98112654

Names & identifiers

Preferred name
1-Fluoro-4-(3-iodopropyl)benzene
IUPAC
1-fluoro-4-(3-iodopropyl)benzene
English name
1-Fluoro-4-(3-iodopropyl)benzene
Molecular formula
C9H10FI
Molecular weight
264.08

Names & synonyms

1-Fluoro-4-(3-iodopropyl)benzene118156-84-6Benzene, 1-fluoro-4-(3-iodopropyl)-MFCD318116044-fluorophenyl propyliodideSCHEMBL3864933-(4-Fluorophenyl)propyliodideDTXSID00593144KZIWHIFUFXAERT-UHFFFAOYSA-N1-(3-Iodopropyl)-4-fluorobenzene3-(4-fluorophenyl)-1-iodopropaneAC3098
Show more names
AKOS037648526BS-14437SY249460CS-0161806F544747

Database identifiers

CAS
118156-84-6
PubChem CID
18364840
DTXSID
DTXSID00593144

Properties

Computed structural properties

XLogP
4
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
97.7

Physicochemical properties

storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
Appearance
Colorless to light yellow Liquid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-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
P261-P305+P351+P338

Chemistry & industry

Suppliers9 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
苏州启航生物科技有限公司18662190603 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]

Related reactions

7 records
New reaction record
HRID 157938 reaction equation
HRID 157938As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 380490 reaction equation
HRID 380490As productuspto-grants-2001_10
HRID 380491 reaction equation
HRID 380491As reactantuspto-grants-2001_10
HRID 422943 reaction equation
HRID 422943As reactantuspto-grants-2012_01
HRID 562645 reaction equation
HRID 562645As reactantuspto-grants-2011_11
HRID 1269422 reaction equation
HRID 1269422As reactantuspto-grants-2007_04
HRID 1869685 reaction equation
HRID 1869685As reactantuspto-grants-2009_12

Compound notes

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