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Alkyl Halides

Organic compounds in which a hydrogen atom or more has been replaced by a halogen atom in an alkane molecule (saturated hydrocarbon chain). Halogen atoms include bromine, chlorine, fluorine, and iodine. Compounds may be in closed ring configurations.
Alkyl bromides (18)
Alkyl fluorides (7)
Cyclohexyl halides (3)
Alkyl chlorides (1)

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3-Bromomethyl-2(1H)-quinoxalinone, tech. 90%

CAS: 62235-61-4 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 MDL Number: MFCD02660613 InChI Key: SOTAKCFOTFCVSS-UHFFFAOYSA-N Synonym: 3-bromomethyl quinoxalin-2-ol,3-bromomethylquinoxalin-2-one,3-bromomethyl-1h-quinoxalin-2-one,3-bromomethyl-2-quinoxalinol,3-bromomethyl-2 1h-quinoxalinone,2 1h-quinoxalinone, 3-bromomethyl,3-bromomethyl hydroquinoxalin-2-one,acmc-20agnv,3-bromomethyl quinoxaline PubChem CID: 286254 IUPAC Name: 3-(bromomethyl)-1H-quinoxalin-2-one SMILES: C1=CC=C2C(=C1)NC(=O)C(=N2)CBr

PubChem CID 286254
CAS 62235-61-4
Molecular Weight (g/mol) 239.072
MDL Number MFCD02660613
SMILES C1=CC=C2C(=C1)NC(=O)C(=N2)CBr
Synonym 3-bromomethyl quinoxalin-2-ol,3-bromomethylquinoxalin-2-one,3-bromomethyl-1h-quinoxalin-2-one,3-bromomethyl-2-quinoxalinol,3-bromomethyl-2 1h-quinoxalinone,2 1h-quinoxalinone, 3-bromomethyl,3-bromomethyl hydroquinoxalin-2-one,acmc-20agnv,3-bromomethyl quinoxaline
IUPAC Name 3-(bromomethyl)-1H-quinoxalin-2-one
InChI Key SOTAKCFOTFCVSS-UHFFFAOYSA-N
Molecular Formula C9H7BrN2O
2

3-Bromopropionitrile 97.0+%, TCI America™

CAS: 2417-90-5 Molecular Formula: C3H4BrN Molecular Weight (g/mol): 133.976 MDL Number: MFCD00001951 InChI Key: CQZIEDXCLQOOEH-UHFFFAOYSA-N Synonym: 3-bromopropionitrile,propanenitrile, 3-bromo,2-bromoethyl cyanide,3-bromopropiononitrile,1-bromo-2-cyanoethane,beta-bromopropionitrile,2-cyanoethyl bromide,propionitrile, 3-bromo,usaf do-51,beta-bromopriopionitrile PubChem CID: 17020 IUPAC Name: 3-bromopropanenitrile SMILES: C(CBr)C#N

PubChem CID 17020
CAS 2417-90-5
Molecular Weight (g/mol) 133.976
MDL Number MFCD00001951
SMILES C(CBr)C#N
Synonym 3-bromopropionitrile,propanenitrile, 3-bromo,2-bromoethyl cyanide,3-bromopropiononitrile,1-bromo-2-cyanoethane,beta-bromopropionitrile,2-cyanoethyl bromide,propionitrile, 3-bromo,usaf do-51,beta-bromopriopionitrile
IUPAC Name 3-bromopropanenitrile
InChI Key CQZIEDXCLQOOEH-UHFFFAOYSA-N
Molecular Formula C3H4BrN
3
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Nonafluorobutanesulfonyl fluoride, 90+%

CAS: 375-72-4 Molecular Formula: C4F10O2S Molecular Weight (g/mol): 302.086 MDL Number: MFCD00007422 InChI Key: LUYQYZLEHLTPBH-UHFFFAOYSA-N Synonym: nonafluorobutanesulfonyl fluoride,perfluorobutanesulfonyl fluoride,perfluoro-1-butanesulfonyl fluoride,perfluorobutanesulfonylfluoride,perfluorobutylsulfonyl fluoride,nonafluorobutanesulphonyl fluoride,perfluoro n-butylsulfonyl fluoride,nonafluorobutane-1-sulfonyl fluoride,nonafluoro-1-butanesulfonyl fluoride,1-butanesulfonyl fluoride, 1,1,2,2,3,3,4,4,4-nonafluoro PubChem CID: 67814 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride SMILES: C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F

PubChem CID 67814
CAS 375-72-4
Molecular Weight (g/mol) 302.086
MDL Number MFCD00007422
SMILES C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F
Synonym nonafluorobutanesulfonyl fluoride,perfluorobutanesulfonyl fluoride,perfluoro-1-butanesulfonyl fluoride,perfluorobutanesulfonylfluoride,perfluorobutylsulfonyl fluoride,nonafluorobutanesulphonyl fluoride,perfluoro n-butylsulfonyl fluoride,nonafluorobutane-1-sulfonyl fluoride,nonafluoro-1-butanesulfonyl fluoride,1-butanesulfonyl fluoride, 1,1,2,2,3,3,4,4,4-nonafluoro
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride
InChI Key LUYQYZLEHLTPBH-UHFFFAOYSA-N
Molecular Formula C4F10O2S
4

Nonafluorovaleric Acid 98.0+%, TCI America™

CAS: 2706-90-3 Molecular Formula: C5HF9O2 Molecular Weight (g/mol): 264.05 MDL Number: MFCD00040211 InChI Key: CXZGQIAOTKWCDB-UHFFFAOYSA-N Synonym: perfluoropentanoic acid,perfluorovaleric acid,nonafluoropentanoic acid,nonafluorovaleric acid,pentanoic acid, nonafluoro,nonafluoro-1-pentanoic acid,valeric acid, nonafluoro,n-perfluoropentanoic acid,perfluoro-n-pentanoic acid,2,2,3,3,4,4,5,5,5-nonafluoro-pentanoic acid PubChem CID: 75921 ChEBI: CHEBI:83491 IUPAC Name: nonafluoropentanoic acid SMILES: OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

PubChem CID 75921
CAS 2706-90-3
Molecular Weight (g/mol) 264.05
ChEBI CHEBI:83491
MDL Number MFCD00040211
SMILES OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Synonym perfluoropentanoic acid,perfluorovaleric acid,nonafluoropentanoic acid,nonafluorovaleric acid,pentanoic acid, nonafluoro,nonafluoro-1-pentanoic acid,valeric acid, nonafluoro,n-perfluoropentanoic acid,perfluoro-n-pentanoic acid,2,2,3,3,4,4,5,5,5-nonafluoro-pentanoic acid
IUPAC Name nonafluoropentanoic acid
InChI Key CXZGQIAOTKWCDB-UHFFFAOYSA-N
Molecular Formula C5HF9O2
5
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1-Bromo-3-methyl-2-butene, 90+%, stab. with silver

CAS: 870-63-3 Molecular Formula: C5H9Br Molecular Weight (g/mol): 149.031 MDL Number: MFCD00000242 InChI Key: LOYZVRIHVZEDMW-UHFFFAOYSA-N Synonym: 1-bromo-3-methyl-2-butene,3,3-dimethylallyl bromide,prenyl bromide,3-methyl-2-butenyl bromide,2-butene, 1-bromo-3-methyl,dimethylallyl bromide,1-bromo-3-methyl-but-2-ene,.gamma.,.gamma.-dimethylallyl bromide,3-methylcrotyl bromide,3,3-dimethylallylbromide PubChem CID: 70092 IUPAC Name: 1-bromo-3-methylbut-2-ene SMILES: CC(=CCBr)C

PubChem CID 70092
CAS 870-63-3
Molecular Weight (g/mol) 149.031
MDL Number MFCD00000242
SMILES CC(=CCBr)C
Synonym 1-bromo-3-methyl-2-butene,3,3-dimethylallyl bromide,prenyl bromide,3-methyl-2-butenyl bromide,2-butene, 1-bromo-3-methyl,dimethylallyl bromide,1-bromo-3-methyl-but-2-ene,.gamma.,.gamma.-dimethylallyl bromide,3-methylcrotyl bromide,3,3-dimethylallylbromide
IUPAC Name 1-bromo-3-methylbut-2-ene
InChI Key LOYZVRIHVZEDMW-UHFFFAOYSA-N
Molecular Formula C5H9Br
6
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3-Bromopropionitrile, 97%

CAS: 2417-90-5 Molecular Formula: C3H4BrN Molecular Weight (g/mol): 133.976 MDL Number: MFCD00001951 InChI Key: CQZIEDXCLQOOEH-UHFFFAOYSA-N Synonym: 3-bromopropionitrile,propanenitrile, 3-bromo,2-bromoethyl cyanide,3-bromopropiononitrile,1-bromo-2-cyanoethane,beta-bromopropionitrile,2-cyanoethyl bromide,propionitrile, 3-bromo,usaf do-51,beta-bromopriopionitrile PubChem CID: 17020 IUPAC Name: 3-bromopropanenitrile SMILES: C(CBr)C#N

PubChem CID 17020
CAS 2417-90-5
Molecular Weight (g/mol) 133.976
MDL Number MFCD00001951
SMILES C(CBr)C#N
Synonym 3-bromopropionitrile,propanenitrile, 3-bromo,2-bromoethyl cyanide,3-bromopropiononitrile,1-bromo-2-cyanoethane,beta-bromopropionitrile,2-cyanoethyl bromide,propionitrile, 3-bromo,usaf do-51,beta-bromopriopionitrile
IUPAC Name 3-bromopropanenitrile
InChI Key CQZIEDXCLQOOEH-UHFFFAOYSA-N
Molecular Formula C3H4BrN
7
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Perfluoropentanoic acid, 97%

CAS: 2706-90-3 Molecular Formula: C5HF9O2 Molecular Weight (g/mol): 264.05 MDL Number: MFCD00040211 InChI Key: CXZGQIAOTKWCDB-UHFFFAOYSA-N Synonym: perfluoropentanoic acid,perfluorovaleric acid,nonafluoropentanoic acid,nonafluorovaleric acid,pentanoic acid, nonafluoro,nonafluoro-1-pentanoic acid,valeric acid, nonafluoro,n-perfluoropentanoic acid,perfluoro-n-pentanoic acid,2,2,3,3,4,4,5,5,5-nonafluoro-pentanoic acid PubChem CID: 75921 ChEBI: CHEBI:83491 IUPAC Name: 2,2,3,3,4,4,5,5,5-nonafluoropentanoic acid SMILES: OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

PubChem CID 75921
CAS 2706-90-3
Molecular Weight (g/mol) 264.05
ChEBI CHEBI:83491
MDL Number MFCD00040211
SMILES OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Synonym perfluoropentanoic acid,perfluorovaleric acid,nonafluoropentanoic acid,nonafluorovaleric acid,pentanoic acid, nonafluoro,nonafluoro-1-pentanoic acid,valeric acid, nonafluoro,n-perfluoropentanoic acid,perfluoro-n-pentanoic acid,2,2,3,3,4,4,5,5,5-nonafluoro-pentanoic acid
IUPAC Name 2,2,3,3,4,4,5,5,5-nonafluoropentanoic acid
InChI Key CXZGQIAOTKWCDB-UHFFFAOYSA-N
Molecular Formula C5HF9O2
8
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Ethyl 4-bromobutyrate, 98%

CAS: 2969-81-5 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.056 MDL Number: MFCD00000259 InChI Key: XBPOBCXHALHJFP-UHFFFAOYSA-N Synonym: ethyl 4-bromobutyrate,4-bromobutyric acid ethyl ester,ethyl-4-bromobutyrate,butanoic acid, 4-bromo-, ethyl ester,ethyl-4-bromotbutyrate,4-bromo-n-butyric acid ethyl ester,brch2ch2ch2c o oc2h5,4-bromo-butyric acid ethyl ester,4-bromo-butanoic acid ethyl ester,gamma-bromobutyric acid ethyl ester PubChem CID: 76300 IUPAC Name: ethyl 4-bromobutanoate SMILES: CCOC(=O)CCCBr

PubChem CID 76300
CAS 2969-81-5
Molecular Weight (g/mol) 195.056
MDL Number MFCD00000259
SMILES CCOC(=O)CCCBr
Synonym ethyl 4-bromobutyrate,4-bromobutyric acid ethyl ester,ethyl-4-bromobutyrate,butanoic acid, 4-bromo-, ethyl ester,ethyl-4-bromotbutyrate,4-bromo-n-butyric acid ethyl ester,brch2ch2ch2c o oc2h5,4-bromo-butyric acid ethyl ester,4-bromo-butanoic acid ethyl ester,gamma-bromobutyric acid ethyl ester
IUPAC Name ethyl 4-bromobutanoate
InChI Key XBPOBCXHALHJFP-UHFFFAOYSA-N
Molecular Formula C6H11BrO2
9
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Ethyl 4-bromobutyrate, 97+%

CAS: 2969-81-5 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.06 InChI Key: XBPOBCXHALHJFP-UHFFFAOYSA-N Synonym: ethyl 4-bromobutyrate,4-bromobutyric acid ethyl ester,ethyl-4-bromobutyrate,butanoic acid, 4-bromo-, ethyl ester,ethyl-4-bromotbutyrate,4-bromo-n-butyric acid ethyl ester,brch2ch2ch2c o oc2h5,4-bromo-butyric acid ethyl ester,4-bromo-butanoic acid ethyl ester,gamma-bromobutyric acid ethyl ester PubChem CID: 76300 IUPAC Name: ethyl 4-bromobutanoate SMILES: CCOC(=O)CCCBr

PubChem CID 76300
CAS 2969-81-5
Molecular Weight (g/mol) 195.06
SMILES CCOC(=O)CCCBr
Synonym ethyl 4-bromobutyrate,4-bromobutyric acid ethyl ester,ethyl-4-bromobutyrate,butanoic acid, 4-bromo-, ethyl ester,ethyl-4-bromotbutyrate,4-bromo-n-butyric acid ethyl ester,brch2ch2ch2c o oc2h5,4-bromo-butyric acid ethyl ester,4-bromo-butanoic acid ethyl ester,gamma-bromobutyric acid ethyl ester
IUPAC Name ethyl 4-bromobutanoate
InChI Key XBPOBCXHALHJFP-UHFFFAOYSA-N
Molecular Formula C6H11BrO2
10
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2-Bromopentane, 90%, tech.

CAS: 107-81-3 Molecular Formula: C5H11Br Molecular Weight (g/mol): 151.05 MDL Number: MFCD00000160 InChI Key: LGAJYTCRJPCZRJ-UHFFFAOYSA-N Synonym: pentane, 2-bromo,2-pentyl bromide,1-methylbutyl bromide,+/--2-bromopentane,sec-amyl bromide,2-bromo-pentane,2-bromanylpentane,2-bromopentane,4-01-00-00312 beilstein handbook reference,ksc176i8j PubChem CID: 7890 IUPAC Name: 2-bromopentane SMILES: CCCC(C)Br

PubChem CID 7890
CAS 107-81-3
Molecular Weight (g/mol) 151.05
MDL Number MFCD00000160
SMILES CCCC(C)Br
Synonym pentane, 2-bromo,2-pentyl bromide,1-methylbutyl bromide,+/--2-bromopentane,sec-amyl bromide,2-bromo-pentane,2-bromanylpentane,2-bromopentane,4-01-00-00312 beilstein handbook reference,ksc176i8j
IUPAC Name 2-bromopentane
InChI Key LGAJYTCRJPCZRJ-UHFFFAOYSA-N
Molecular Formula C5H11Br
11
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Perfluoro-1-butanesulfonyl fluoride, 92%

CAS: 375-72-4 Molecular Formula: C4F10O2S Molecular Weight (g/mol): 302.09 MDL Number: MFCD00007422 InChI Key: LUYQYZLEHLTPBH-UHFFFAOYSA-N Synonym: nonafluorobutanesulfonyl fluoride,perfluorobutanesulfonyl fluoride,perfluoro-1-butanesulfonyl fluoride,perfluorobutanesulfonylfluoride,perfluorobutylsulfonyl fluoride,nonafluorobutanesulphonyl fluoride,perfluoro n-butylsulfonyl fluoride,nonafluorobutane-1-sulfonyl fluoride,nonafluoro-1-butanesulfonyl fluoride,1-butanesulfonyl fluoride, 1,1,2,2,3,3,4,4,4-nonafluoro PubChem CID: 67814 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride SMILES: C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F

PubChem CID 67814
CAS 375-72-4
Molecular Weight (g/mol) 302.09
MDL Number MFCD00007422
SMILES C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F
Synonym nonafluorobutanesulfonyl fluoride,perfluorobutanesulfonyl fluoride,perfluoro-1-butanesulfonyl fluoride,perfluorobutanesulfonylfluoride,perfluorobutylsulfonyl fluoride,nonafluorobutanesulphonyl fluoride,perfluoro n-butylsulfonyl fluoride,nonafluorobutane-1-sulfonyl fluoride,nonafluoro-1-butanesulfonyl fluoride,1-butanesulfonyl fluoride, 1,1,2,2,3,3,4,4,4-nonafluoro
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride
InChI Key LUYQYZLEHLTPBH-UHFFFAOYSA-N
Molecular Formula C4F10O2S
12

Medchemexpress LLC Perfluoropentanoic acid | 2706-90-3 | 98.0% | 264.05 | 5 G
SDP

Perfluoropentanoic acid (PFPeA), a short-chain perfluorinated compound, serves as an important indicator of perfluorinated compound pollution in ecosystems. It exhibits certain toxicity to mice and can significantly affect the structure and spatial distribution of planktonic microbial communities, potentially threatening water quality through microbial metabolism.

  • Target: Biochemical assay reagents; PPAR; interleukin related; S100 protein
  • Pathway: Others; cell cycle/DNA damage; metabolic enzyme/protease; vitamin D related/nuclear receptor; immunology/inflammation

ENCOMPASS_PREFERRED
13

Medchemexpress LLC Spi-112 | 1051387-90-6 | 98.0% | 468.46 | C22H17FN4O5S | 5 MG
SDP

SPI-112 is a small-molecule, selective and competitive inhibitor of SHP2 (PTPN11) used for biochemical and cellular research. It inhibits SHP2 and related protein tyrosine phosphatases and is supplied as a solid with guidance for storage and preparation of solution stocks.

  • Selective and competitive inhibition of SHP2 for pathway studies.
  • Reported IC50 values support biochemical assay characterization.
  • High purity solid suitable for preparation of DMSO stocks.
  • Available in small milligram quantities and as a prepared solution for convenience.
  • Storage recommendations provided to preserve compound stability.

ENCOMPASS_PREFERRED
14

eMolecules​ 2417-90-5 | 3-BROMOPROPIONITRILE | AstaTech | MFCD00001951 | 133.976 | C3H4BrN | 95.000 | BrCCC#N | 25g | 454893515

3-BROMOPROPIONITRILE | AstaTech | 2417-90-5 | MFCD00001951 | 133.976 | C3H4BrN | 95.000 | BrCCC#N | 25g | 454893515

ENCOMPASS_PREFERRED
15

Sigma Aldrich 3-Bromopropionitrile

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.

ENCOMPASS ENCOMPASS_PREFERRED
Boiling Point 76°C to 78°C (10 mmHg)
Percent Purity ≥98.0% (GC)
Linear Formula BrCH2CH2CN
CAS 2417-90-5
Molecular Weight (g/mol) 133.97
MDL Number MFCD00001951
Refractive Index n20/D 1.481 (literature)
RTECS Number UG1050000
Recommended Storage Room Temperature
Molecular Formula C3H4BrN
EINECS Number 219-332-4
Density 1.615 g/mL (at 25°C (literature))