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2-(3-fluorophenyl)-1H-imidazole

HCID 316816
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
27423-79-6
Standard SMILES
Fc1cccc(-c2ncc[nH]2)c1
InChIKey
JAHNSTQSQJOJLO-UHFFFAOYSA-N
Molecular formula
C9H7FN2
Average molar mass
162.16 g/mol
Monoisotopic mass
162.05932644

Names & identifiers

Preferred name
2-(3-fluorophenyl)-1H-imidazole
IUPAC
2-(3-fluorophenyl)-1H-imidazole
English name
2-(3-FLUORO-PHENYL)-1H-IMIDAZOLE
Molecular formula
C9H7FN2
Molecular weight
162.16

Names & synonyms

2-(3-fluorophenyl)-1H-imidazole27423-79-6MFCD08668729NSC2452052-(3-FLUORO-PHENYL)-1H-IMIDAZOLESCHEMBL1688521SCHEMBL2651262DTXSID30311777JAHNSTQSQJOJLO-UHFFFAOYSA-N1H-Imidazole, 2-(3-fluorophenyl)-3-fluoro-(1H-imidazol-2-yl)benzeneAKOS010225819
Show more names
NSC-245205NCGC00374423-01H39222F515395F8884-5344

Database identifiers

CAS
27423-79-6
PubChem CID
316816
DTXSID
DTXSID30311777
Nikkaji
J2.059.136F

Properties

Computed structural properties

XLogP
2
Topological polar surface area
28.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
151

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Aminoacetaldehyde dimethyl acetal3-Fluorobenzonitrile

Suppliers8 total

苏州岚云医药科技有限公司2332782371 · [email protected]
上海太氟医药科技有限公司13524951390 18930958102 · [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]
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
四川山冈生物医药科技有限公司13990000934,13076045191 13990000934 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]

Related reactions

5 records
New reaction record
HRID 42279 reaction equation
HRID 42279As productuspto-grants-2013_09
HRID 181009 reaction equation
HRID 181009As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 586374 reaction equation
HRID 586374As reactantuspto-grants-2005_08
HRID 2096313 reaction equation
HRID 2096313As productuspto-grants-2013_05
HRID 2274472 reaction equation
HRID 2274472As productuspto-grants-2015_09

Compound notes

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