Organofluorides

Organic compounds that contain one or more fluorine atoms.

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1,2-Dibromohexafluoropropane, 95%

CAS: 661-95-0 Molecular Formula: C3Br2F6 Molecular Weight (g/mol): 309.83 MDL Number: MFCD00013568 InChI Key: KTULQNFKNLFOHL-UHFFFAOYNA-N Synonym: 1,2-dibromohexafluoropropane,propane, 1,2-dibromo-1,1,2,3,3,3-hexafluoro PubChem CID: 69579 IUPAC Name: 1,2-dibromo-1,1,2,3,3,3-hexafluoropropane SMILES: FC(F)(F)C(F)(Br)C(F)(F)Br

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PubChem CID	69579
CAS	661-95-0
Molecular Weight (g/mol)	309.83
MDL Number	MFCD00013568
SMILES	FC(F)(F)C(F)(Br)C(F)(F)Br
Synonym	1,2-dibromohexafluoropropane,propane, 1,2-dibromo-1,1,2,3,3,3-hexafluoro
IUPAC Name	1,2-dibromo-1,1,2,3,3,3-hexafluoropropane
InChI Key	KTULQNFKNLFOHL-UHFFFAOYNA-N
Molecular Formula	C3Br2F6

Octadecafluorodecahydronaphthalene 95.0+%, TCI America™

CAS: 306-94-5 Molecular Formula: C10F18 Molecular Weight (g/mol): 462.081 MDL Number: MFCD00010626 InChI Key: UWEYRJFJVCLAGH-UHFFFAOYSA-N Synonym: perfluorodecalin,perflunafene,octadecafluorodecahydronaphthalene,cis-perfluorodecalin,trans-perfluorodecalin,perfluorodecahydronaphthalene,naphthalene, octadecafluorodecahydro,f-dc,pp 5,perflunafenum latin PubChem CID: 9386 ChEBI: CHEBI:38848 IUPAC Name: 1,1,2,2,3,3,4,4,4a,5,5,6,6,7,7,8,8,8a-octadecafluoronaphthalene SMILES: C12(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F

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PubChem CID	9386
CAS	306-94-5
Molecular Weight (g/mol)	462.081
ChEBI	CHEBI:38848
MDL Number	MFCD00010626
SMILES	C12(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F
Synonym	perfluorodecalin,perflunafene,octadecafluorodecahydronaphthalene,cis-perfluorodecalin,trans-perfluorodecalin,perfluorodecahydronaphthalene,naphthalene, octadecafluorodecahydro,f-dc,pp 5,perflunafenum latin
IUPAC Name	1,1,2,2,3,3,4,4,4a,5,5,6,6,7,7,8,8,8a-octadecafluoronaphthalene
InChI Key	UWEYRJFJVCLAGH-UHFFFAOYSA-N
Molecular Formula	C10F18

Perfluorohexanes, 98+%, Thermo Scientific Chemicals

CAS: 355-42-0 Molecular Formula: C6F14 Molecular Weight (g/mol): 338.044 MDL Number: MFCD00000437 InChI Key: ZJIJAJXFLBMLCK-UHFFFAOYSA-N Synonym: perfluorohexane,perflexane,tetradecafluorohexane,perfluoro-n-hexane,flutec pp1,hexane, tetradecafluoro,n-tetradecafluorohexane,fluorinert fc72,perfluorohexanes,perflexane usan:inn PubChem CID: 9639 ChEBI: CHEBI:39427 IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F

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PubChem CID	9639
CAS	355-42-0
Molecular Weight (g/mol)	338.044
ChEBI	CHEBI:39427
MDL Number	MFCD00000437
SMILES	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F
Synonym	perfluorohexane,perflexane,tetradecafluorohexane,perfluoro-n-hexane,flutec pp1,hexane, tetradecafluoro,n-tetradecafluorohexane,fluorinert fc72,perfluorohexanes,perflexane usan:inn
IUPAC Name	1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
InChI Key	ZJIJAJXFLBMLCK-UHFFFAOYSA-N
Molecular Formula	C6F14

1-Fluoroadamantane 98.0+%, TCI America™

CAS: 768-92-3 Molecular Formula: C10H15F Molecular Weight (g/mol): 154.228 InChI Key: CPWSNJSGSXXVLD-UHFFFAOYSA-N Synonym: 1-Adamantyl Fluoride PubChem CID: 136608 IUPAC Name: 1-fluoroadamantane SMILES: C1C2CC3CC1CC(C2)(C3)F

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PubChem CID	136608
CAS	768-92-3
Molecular Weight (g/mol)	154.228
SMILES	C1C2CC3CC1CC(C2)(C3)F
Synonym	1-Adamantyl Fluoride
IUPAC Name	1-fluoroadamantane
InChI Key	CPWSNJSGSXXVLD-UHFFFAOYSA-N
Molecular Formula	C10H15F

1,8-Dibromohexadecafluorooctane 97.0+%, TCI America™

CAS: 812-58-8 Molecular Formula: C8Br2F16 Molecular Weight (g/mol): 559.87 MDL Number: MFCD00153111 InChI Key: LYRJPHOHVRHNQH-UHFFFAOYSA-N Synonym: 1,8-Dibromoperfluorooctane PubChem CID: 2736786 IUPAC Name: 1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane SMILES: FC(F)(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br

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PubChem CID	2736786
CAS	812-58-8
Molecular Weight (g/mol)	559.87
MDL Number	MFCD00153111
SMILES	FC(F)(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br
Synonym	1,8-Dibromoperfluorooctane
IUPAC Name	1,8-dibromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane
InChI Key	LYRJPHOHVRHNQH-UHFFFAOYSA-N
Molecular Formula	C8Br2F16

1H,1H-Undecafluorohexylamine 97.0+%, TCI America™

CAS: 355-34-0 Molecular Formula: C6H4F11N Molecular Weight (g/mol): 299.087 MDL Number: MFCD09025929 InChI Key: FDIHRNYGDZQEAV-UHFFFAOYSA-N Synonym: 1H,1H-Perfluorohexylamine PubChem CID: 21923864 IUPAC Name: 2,2,3,3,4,4,5,5,6,6,6-undecafluorohexan-1-amine SMILES: C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)N

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PubChem CID	21923864
CAS	355-34-0
Molecular Weight (g/mol)	299.087
MDL Number	MFCD09025929
SMILES	C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)N
Synonym	1H,1H-Perfluorohexylamine
IUPAC Name	2,2,3,3,4,4,5,5,6,6,6-undecafluorohexan-1-amine
InChI Key	FDIHRNYGDZQEAV-UHFFFAOYSA-N
Molecular Formula	C6H4F11N

Fluoroacetonitrile 98.0+%, TCI America™

CAS: 503-20-8 Molecular Formula: C2H2FN Molecular Weight (g/mol): 59.043 MDL Number: MFCD00009969 InChI Key: GNFVFPBRMLIKIM-UHFFFAOYSA-N PubChem CID: 10420 IUPAC Name: 2-fluoroacetonitrile SMILES: C(C#N)F

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PubChem CID	10420
CAS	503-20-8
Molecular Weight (g/mol)	59.043
MDL Number	MFCD00009969
SMILES	C(C#N)F
IUPAC Name	2-fluoroacetonitrile
InChI Key	GNFVFPBRMLIKIM-UHFFFAOYSA-N
Molecular Formula	C2H2FN

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7-(Trifluoromethyl)quinoline, 97%

CAS: 325-14-4 Molecular Formula: C10H6F3N Molecular Weight (g/mol): 197.16 MDL Number: MFCD00833760 InChI Key: CMMSEFHVUYEEDY-UHFFFAOYSA-N Synonym: 7-trifluoromethyl quinoline,7-cf3 quinoline,7-trrfluoromethylquinoline,pubchem7218,7-trifluoromethyl-quinoline,acmc-20a40f,quinoline,7-trifluoromethyl,quinoline, 7-trifluoromethyl PubChem CID: 459614 IUPAC Name: 7-(trifluoromethyl)quinoline SMILES: C1=CC2=C(C=C(C=C2)C(F)(F)F)N=C1

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PubChem CID	459614
CAS	325-14-4
Molecular Weight (g/mol)	197.16
MDL Number	MFCD00833760
SMILES	C1=CC2=C(C=C(C=C2)C(F)(F)F)N=C1
Synonym	7-trifluoromethyl quinoline,7-cf3 quinoline,7-trrfluoromethylquinoline,pubchem7218,7-trifluoromethyl-quinoline,acmc-20a40f,quinoline,7-trifluoromethyl,quinoline, 7-trifluoromethyl
IUPAC Name	7-(trifluoromethyl)quinoline
InChI Key	CMMSEFHVUYEEDY-UHFFFAOYSA-N
Molecular Formula	C10H6F3N

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Perfluorooctyl bromide, 99%

CAS: 423-55-2 Molecular Formula: C8BrF17 Molecular Weight (g/mol): 498.97 MDL Number: MFCD00042082 InChI Key: WTWWXOGTJWMJHI-UHFFFAOYSA-N Synonym: perflubron,1-bromoperfluorooctane,perfluorooctyl bromide,1-bromoheptadecafluorooctane,oxygent,perfluoro-n-octyl bromide,imagent gi,perfluorooctylbromide,liquivent,perfluoroctyl bromide PubChem CID: 9873 ChEBI: CHEBI:38803 IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane SMILES: FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br

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PubChem CID	9873
CAS	423-55-2
Molecular Weight (g/mol)	498.97
ChEBI	CHEBI:38803
MDL Number	MFCD00042082
SMILES	FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br
Synonym	perflubron,1-bromoperfluorooctane,perfluorooctyl bromide,1-bromoheptadecafluorooctane,oxygent,perfluoro-n-octyl bromide,imagent gi,perfluorooctylbromide,liquivent,perfluoroctyl bromide
IUPAC Name	1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane
InChI Key	WTWWXOGTJWMJHI-UHFFFAOYSA-N
Molecular Formula	C8BrF17

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2-(Trifluoromethyl)pyrazine, 97%, Thermo Scientific™

CAS: 61655-67-2 Molecular Formula: C₅H₃F₃N₂ Molecular Weight (g/mol): 148.09 MDL Number: MFCD06797734 InChI Key: CEAMSISEJZMQEP-UHFFFAOYSA-N Synonym: 2-trifluoromethyl pyrazine,2-trifluoromethyl-pyrazine,pyrazine, trifluoromethyl,trifluoromethylpyrazine,pyrazine, 2-trifluoromethyl PubChem CID: 17888936 IUPAC Name: 2-(trifluoromethyl)pyrazine SMILES: C1=CN=C(C=N1)C(F)(F)F

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PubChem CID	17888936
CAS	61655-67-2
Molecular Weight (g/mol)	148.09
MDL Number	MFCD06797734
SMILES	C1=CN=C(C=N1)C(F)(F)F
Synonym	2-trifluoromethyl pyrazine,2-trifluoromethyl-pyrazine,pyrazine, trifluoromethyl,trifluoromethylpyrazine,pyrazine, 2-trifluoromethyl
IUPAC Name	2-(trifluoromethyl)pyrazine
InChI Key	CEAMSISEJZMQEP-UHFFFAOYSA-N
Molecular Formula	C₅H₃F₃N₂

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4-(Trifluoromethyl)indole, 97%

CAS: 128562-95-8 Molecular Formula: C9H6F3N Molecular Weight (g/mol): 185.15 MDL Number: MFCD09954766 InChI Key: YTVBZSLUNRYKID-UHFFFAOYSA-N Synonym: 4-trifluoromethyl-1h-indole,4-trifluoromethyl indole,4-trifluoromethyl-indole,4-trifluoromethylindole,1h-indole, 4-trifluoromethyl PubChem CID: 19803703 IUPAC Name: 4-(trifluoromethyl)-1H-indole SMILES: FC(F)(F)C1=C2C=CNC2=CC=C1

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PubChem CID	19803703
CAS	128562-95-8
Molecular Weight (g/mol)	185.15
MDL Number	MFCD09954766
SMILES	FC(F)(F)C1=C2C=CNC2=CC=C1
Synonym	4-trifluoromethyl-1h-indole,4-trifluoromethyl indole,4-trifluoromethyl-indole,4-trifluoromethylindole,1h-indole, 4-trifluoromethyl
IUPAC Name	4-(trifluoromethyl)-1H-indole
InChI Key	YTVBZSLUNRYKID-UHFFFAOYSA-N
Molecular Formula	C9H6F3N

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Diethyl 4,4-difluoropimelate, 97%, Thermo Scientific™

CAS: 22515-16-8 Molecular Formula: C11H18F2O4 Molecular Weight (g/mol): 252.26 MDL Number: MFCD08146634 InChI Key: XUOBBVMKXUPPEW-UHFFFAOYSA-N Synonym: 4,4-difluoroheptanedioic acid diethyl ester,1,7-diethyl 4,4-difluoroheptanedioate,diethyl 4,4-difluoropimelate,pubchem22650,diethyl 4,4-heptanedioate,ksc494q0l,diethyl4,4-difluoroheptanedioate,diethyl 4,4-difluoroheptane-1,7-dioate,4,4-difluoro-heptanedioic acid diethyl ester,heptanedioicacid,4,4-difluoro-,1,7-diethylester PubChem CID: 10264195 IUPAC Name: diethyl 4,4-difluoroheptanedioate SMILES: CCOC(=O)CCC(F)(F)CCC(=O)OCC

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PubChem CID	10264195
CAS	22515-16-8
Molecular Weight (g/mol)	252.26
MDL Number	MFCD08146634
SMILES	CCOC(=O)CCC(F)(F)CCC(=O)OCC
Synonym	4,4-difluoroheptanedioic acid diethyl ester,1,7-diethyl 4,4-difluoroheptanedioate,diethyl 4,4-difluoropimelate,pubchem22650,diethyl 4,4-heptanedioate,ksc494q0l,diethyl4,4-difluoroheptanedioate,diethyl 4,4-difluoroheptane-1,7-dioate,4,4-difluoro-heptanedioic acid diethyl ester,heptanedioicacid,4,4-difluoro-,1,7-diethylester
IUPAC Name	diethyl 4,4-difluoroheptanedioate
InChI Key	XUOBBVMKXUPPEW-UHFFFAOYSA-N
Molecular Formula	C11H18F2O4

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2-(Trifluoromethyl)pyridine, 97%, Thermo Scientific™

CAS: 368-48-9 Molecular Formula: C6H4F3N Molecular Weight (g/mol): 147.10 MDL Number: MFCD02183562 InChI Key: ATRQECRSCHYSNP-UHFFFAOYSA-N Synonym: 2-trifluoromethyl pyridine,2-trifluoromethyl-pyridine,trifluoromethylpyridine,2-1,1,1-trifluoromethyl pyridine,pyridine, trifluoromethyl,alpha,alpha,alpha-trifluoro-2-picoline,2-cf3-pyridine,trifluoromethyl pyridine PubChem CID: 136199 IUPAC Name: 2-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CC=CC=N1

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PubChem CID	136199
CAS	368-48-9
Molecular Weight (g/mol)	147.10
MDL Number	MFCD02183562
SMILES	FC(F)(F)C1=CC=CC=N1
Synonym	2-trifluoromethyl pyridine,2-trifluoromethyl-pyridine,trifluoromethylpyridine,2-1,1,1-trifluoromethyl pyridine,pyridine, trifluoromethyl,alpha,alpha,alpha-trifluoro-2-picoline,2-cf3-pyridine,trifluoromethyl pyridine
IUPAC Name	2-(trifluoromethyl)pyridine
InChI Key	ATRQECRSCHYSNP-UHFFFAOYSA-N
Molecular Formula	C6H4F3N

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2-Chloro-1,1,2-trifluoroethyl difluoromethyl ether, 97%

CAS: 13838-16-9 Molecular Formula: C3H2ClF5O Molecular Weight (g/mol): 184.49 MDL Number: MFCD00069095 InChI Key: JPGQOUSTVILISH-UHFFFAOYNA-N Synonym: enflurane,methylflurether,efrane,ethrane,2-chloro-1-difluoromethoxy-1,1,2-trifluoroethane,alyrane,anesthetic 347,2-chloro-1,1,2-trifluoroethyl difluoromethyl ether,compound 347,anesthetic compound no. 347 PubChem CID: 3226 ChEBI: CHEBI:4792 IUPAC Name: 2-chloro-1-(difluoromethoxy)-1,1,2-trifluoroethane SMILES: FC(F)OC(F)(F)C(F)Cl

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PubChem CID	3226
CAS	13838-16-9
Molecular Weight (g/mol)	184.49
ChEBI	CHEBI:4792
MDL Number	MFCD00069095
SMILES	FC(F)OC(F)(F)C(F)Cl
Synonym	enflurane,methylflurether,efrane,ethrane,2-chloro-1-difluoromethoxy-1,1,2-trifluoroethane,alyrane,anesthetic 347,2-chloro-1,1,2-trifluoroethyl difluoromethyl ether,compound 347,anesthetic compound no. 347
IUPAC Name	2-chloro-1-(difluoromethoxy)-1,1,2-trifluoroethane
InChI Key	JPGQOUSTVILISH-UHFFFAOYNA-N
Molecular Formula	C3H2ClF5O

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2-(Trifluoromethyl)-1H-indole, 97%, Thermo Scientific™

CAS: 51310-54-4 Molecular Formula: C₉H₆F₃N Molecular Weight (g/mol): 185.15 InChI Key: QFHVHZJGQWMBTE-UHFFFAOYSA-N Synonym: 2-trifluoromethyl-1h-indole,2-trifluoromethylindole,1h-indole, 2-trifluoromethyl,pubchem23796,2-trifluoromethyl indole PubChem CID: 10932124 IUPAC Name: 2-(trifluoromethyl)-1H-indole SMILES: C1=CC=C2C(=C1)C=C(N2)C(F)(F)F

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Specifications

PubChem CID	10932124
CAS	51310-54-4
Molecular Weight (g/mol)	185.15
SMILES	C1=CC=C2C(=C1)C=C(N2)C(F)(F)F
Synonym	2-trifluoromethyl-1h-indole,2-trifluoromethylindole,1h-indole, 2-trifluoromethyl,pubchem23796,2-trifluoromethyl indole
IUPAC Name	2-(trifluoromethyl)-1H-indole
InChI Key	QFHVHZJGQWMBTE-UHFFFAOYSA-N
Molecular Formula	C₉H₆F₃N

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