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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Organic compounds in which a hydrogen atom or more has been replaced by a halogen atom in an alkane molecule (saturated hydrocarbon chain).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 (710)
Alkyl fluorides (100)
Halomethanes (90)
Cyclohexyl halides (48)
Alkyl chlorides (41)
Alkyl iodides (29)

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1

2-(Bromomethyl)-1,3-benzothiazole, 95%, Thermo Scientific™

CAS: 106086-78-6 Molecular Formula: C8H6BrNS Molecular Weight (g/mol): 228.107 InChI Key: WFLCAOGKZQTOIG-UHFFFAOYSA-N Synonym: 2-bromomethyl-1,3-benzothiazole,2-bromomethyl benzo d thiazole,2-bromomethyl benzothiazole,benzothiazole, 2-bromomethyl,benzo d thiazol-2-yl methyl bromide,zlchem 58,pubchem3912,acmc-1bpju,2-bromomethylbenzothiazole PubChem CID: 2776258 IUPAC Name: 2-(bromomethyl)-1,3-benzothiazole SMILES: C1=CC=C2C(=C1)N=C(S2)CBr

PubChem CID 2776258
CAS 106086-78-6
Molecular Weight (g/mol) 228.107
SMILES C1=CC=C2C(=C1)N=C(S2)CBr
Synonym 2-bromomethyl-1,3-benzothiazole,2-bromomethyl benzo d thiazole,2-bromomethyl benzothiazole,benzothiazole, 2-bromomethyl,benzo d thiazol-2-yl methyl bromide,zlchem 58,pubchem3912,acmc-1bpju,2-bromomethylbenzothiazole
IUPAC Name 2-(bromomethyl)-1,3-benzothiazole
InChI Key WFLCAOGKZQTOIG-UHFFFAOYSA-N
Molecular Formula C8H6BrNS
2

1-Bromononane, 99%

CAS: 693-58-3 Molecular Formula: C9H19Br Molecular Weight (g/mol): 207.155 MDL Number: MFCD00000278 InChI Key: AYMUQTNXKPEMLM-UHFFFAOYSA-N Synonym: n-nonyl bromide,nonyl bromide,nonane, 1-bromo,1-nonyl bromide,1-n-nonyl bromide,n-nonyl-1-bromide,bromononane,nonylbromide,1-bromo-n-nonane,labotest-bb ltbb001163 PubChem CID: 12742 IUPAC Name: 1-bromononane SMILES: CCCCCCCCCBr

PubChem CID 12742
CAS 693-58-3
Molecular Weight (g/mol) 207.155
MDL Number MFCD00000278
SMILES CCCCCCCCCBr
Synonym n-nonyl bromide,nonyl bromide,nonane, 1-bromo,1-nonyl bromide,1-n-nonyl bromide,n-nonyl-1-bromide,bromononane,nonylbromide,1-bromo-n-nonane,labotest-bb ltbb001163
IUPAC Name 1-bromononane
InChI Key AYMUQTNXKPEMLM-UHFFFAOYSA-N
Molecular Formula C9H19Br
3

4-Bromobutyronitrile, 97%

CAS: 5332-06-9 Molecular Formula: C4H6BrN Molecular Weight (g/mol): 148.00 MDL Number: MFCD00001971 InChI Key: CQPGDDAKTTWVDD-UHFFFAOYSA-N Synonym: 4-bromobutyronitrile,butanenitrile, 4-bromo,1-bromo-3-cyanopropane,3-bromopropyl cyanide,3-cyanopropyl bromide,gamma-bromobutyronitrile,butyronitrile, 4-bromo,usaf do-6,4-bromo butyronitrile,trimethylene bromocyanide PubChem CID: 21412 IUPAC Name: 4-bromobutanenitrile SMILES: C(CC#N)CBr

PubChem CID 21412
CAS 5332-06-9
Molecular Weight (g/mol) 148.00
MDL Number MFCD00001971
SMILES C(CC#N)CBr
Synonym 4-bromobutyronitrile,butanenitrile, 4-bromo,1-bromo-3-cyanopropane,3-bromopropyl cyanide,3-cyanopropyl bromide,gamma-bromobutyronitrile,butyronitrile, 4-bromo,usaf do-6,4-bromo butyronitrile,trimethylene bromocyanide
IUPAC Name 4-bromobutanenitrile
InChI Key CQPGDDAKTTWVDD-UHFFFAOYSA-N
Molecular Formula C4H6BrN
4

4-Bromo-1-butene, 97%

CAS: 5162-44-7 Molecular Formula: C4H7Br MDL Number: MFCD00000258 InChI Key: DMAYBPBPEUFIHJ-UHFFFAOYSA-N Synonym: 4-bromo-1-butene,3-butenyl bromide,1-butene, 4-bromo,4-bromo-1-buten,4-bromo-but-1-ene,homoallyl bromide,1-bromo-3-butene,4-bromobutene,4-bromo-1 butene,sjphabijuh@ PubChem CID: 21241 IUPAC Name: 4-bromobut-1-ene

PubChem CID 21241
CAS 5162-44-7
MDL Number MFCD00000258
Synonym 4-bromo-1-butene,3-butenyl bromide,1-butene, 4-bromo,4-bromo-1-buten,4-bromo-but-1-ene,homoallyl bromide,1-bromo-3-butene,4-bromobutene,4-bromo-1 butene,sjphabijuh@
IUPAC Name 4-bromobut-1-ene
InChI Key DMAYBPBPEUFIHJ-UHFFFAOYSA-N
Molecular Formula C4H7Br
5

5-Bromo-1-pentene, 96%

CAS: 1119-51-3 Molecular Formula: C5H9Br Molecular Weight (g/mol): 149.031 MDL Number: MFCD0000-364 InChI Key: LPNANKDXVBMDKE-UHFFFAOYSA-N Synonym: 5-bromo-1-pentene,1-pentene, 5-bromo,1-bromo-4-pentene,4-pentenyl bromide,5-bromopentene,5-bromo-pent-1-ene,5-bromo-pentene,5-bromopentene-1,5-bromo-1-amylene,pent-4-enyl bromide PubChem CID: 70704 IUPAC Name: 5-bromopent-1-ene SMILES: C=CCCCBr

PubChem CID 70704
CAS 1119-51-3
Molecular Weight (g/mol) 149.031
MDL Number MFCD0000-364
SMILES C=CCCCBr
Synonym 5-bromo-1-pentene,1-pentene, 5-bromo,1-bromo-4-pentene,4-pentenyl bromide,5-bromopentene,5-bromo-pent-1-ene,5-bromo-pentene,5-bromopentene-1,5-bromo-1-amylene,pent-4-enyl bromide
IUPAC Name 5-bromopent-1-ene
InChI Key LPNANKDXVBMDKE-UHFFFAOYSA-N
Molecular Formula C5H9Br
6

1-Bromodecane, 98%

CAS: 112-29-8 Molecular Formula: C10H21Br Molecular Weight (g/mol): 221.18 MDL Number: MFCD00000221 InChI Key: MYMSJFSOOQERIO-UHFFFAOYSA-N Synonym: decyl bromide,n-decyl bromide,decane, 1-bromo,1-decyl bromide,decylbromide,bromodecane,decane, bromo,labotest-bb ltbb001164,decylmonobromide,n-decylbromide PubChem CID: 8173 IUPAC Name: 1-bromodecane SMILES: CCCCCCCCCCBr

PubChem CID 8173
CAS 112-29-8
Molecular Weight (g/mol) 221.18
MDL Number MFCD00000221
SMILES CCCCCCCCCCBr
Synonym decyl bromide,n-decyl bromide,decane, 1-bromo,1-decyl bromide,decylbromide,bromodecane,decane, bromo,labotest-bb ltbb001164,decylmonobromide,n-decylbromide
IUPAC Name 1-bromodecane
InChI Key MYMSJFSOOQERIO-UHFFFAOYSA-N
Molecular Formula C10H21Br
7

Bromoform, 96%, stab. with ethanol

CAS: 75-25-2 Molecular Formula: CHBr3 Molecular Weight (g/mol): 252.731 MDL Number: MFCD00000128 InChI Key: DIKBFYAXUHHXCS-UHFFFAOYSA-N Synonym: tribromomethane,methane, tribromo,tribrommethan,methenyl tribromide,methyl tribromide,tribrommethaan,tribromometan,bromoforme,bromoformio,rcra waste number u225 PubChem CID: 5558 ChEBI: CHEBI:38682 IUPAC Name: bromoform SMILES: C(Br)(Br)Br

PubChem CID 5558
CAS 75-25-2
Molecular Weight (g/mol) 252.731
ChEBI CHEBI:38682
MDL Number MFCD00000128
SMILES C(Br)(Br)Br
Synonym tribromomethane,methane, tribromo,tribrommethan,methenyl tribromide,methyl tribromide,tribrommethaan,tribromometan,bromoforme,bromoformio,rcra waste number u225
IUPAC Name bromoform
InChI Key DIKBFYAXUHHXCS-UHFFFAOYSA-N
Molecular Formula CHBr3
8

1-BOC-3-(bromomethyl)azetidine, 95%

CAS: 253176-93-1 Molecular Formula: C9H16BrNO2 Molecular Weight (g/mol): 250.14 MDL Number: MFCD16556174 InChI Key: PUKCUGDJEPVLPR-UHFFFAOYSA-N Synonym: 1-boc-3-bromomethyl azetidine,tert-butyl 3-bromomethyl azetidine-1-carboxylate,1-boc-3-bromomethylazetidine,n-tert-butoxycarbonyl-3-bromomethylazetidine,3-bromomethyl-azetidine-1-carboxylic acid tert-butyl ester,acmc-209d8t,1-n-boc-3-bromomethyl azetidine,tert-butyl 3-bromomethyl-1-azetidinecarboxylate,tert-butyl 3-bromomethyl ;azetidine-1-carboxylate,2-methyl-2-propanyl 3-bromomethyl-1-azetidinecarboxylate PubChem CID: 53350331 IUPAC Name: tert-butyl 3-(bromomethyl)azetidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CC(CBr)C1

PubChem CID 53350331
CAS 253176-93-1
Molecular Weight (g/mol) 250.14
MDL Number MFCD16556174
SMILES CC(C)(C)OC(=O)N1CC(CBr)C1
Synonym 1-boc-3-bromomethyl azetidine,tert-butyl 3-bromomethyl azetidine-1-carboxylate,1-boc-3-bromomethylazetidine,n-tert-butoxycarbonyl-3-bromomethylazetidine,3-bromomethyl-azetidine-1-carboxylic acid tert-butyl ester,acmc-209d8t,1-n-boc-3-bromomethyl azetidine,tert-butyl 3-bromomethyl-1-azetidinecarboxylate,tert-butyl 3-bromomethyl ;azetidine-1-carboxylate,2-methyl-2-propanyl 3-bromomethyl-1-azetidinecarboxylate
IUPAC Name tert-butyl 3-(bromomethyl)azetidine-1-carboxylate
InChI Key PUKCUGDJEPVLPR-UHFFFAOYSA-N
Molecular Formula C9H16BrNO2
9

6-Bromo-1-hexene, 97%

CAS: 2695-47-8 Molecular Formula: C6H11Br Molecular Weight (g/mol): 163.06 MDL Number: MFCD00000269 InChI Key: RIMXEJYJXDBLIE-UHFFFAOYSA-N Synonym: 6-bromo-1-hexene,5-hexenyl bromide,1-hexene, 6-bromo,1-bromo-5-hexene,6-bromohexene,6-bromo-hexene,6-bromo-hex-1-ene,l-bromo-5-hexene,6-bromo-1-hexen,1-bromohex-5-ene PubChem CID: 75906 IUPAC Name: 6-bromohex-1-ene SMILES: C=CCCCCBr

PubChem CID 75906
CAS 2695-47-8
Molecular Weight (g/mol) 163.06
MDL Number MFCD00000269
SMILES C=CCCCCBr
Synonym 6-bromo-1-hexene,5-hexenyl bromide,1-hexene, 6-bromo,1-bromo-5-hexene,6-bromohexene,6-bromo-hexene,6-bromo-hex-1-ene,l-bromo-5-hexene,6-bromo-1-hexen,1-bromohex-5-ene
IUPAC Name 6-bromohex-1-ene
InChI Key RIMXEJYJXDBLIE-UHFFFAOYSA-N
Molecular Formula C6H11Br
10

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
11

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
12

Bromoacetonitrile, 96%

CAS: 590-17-0 Molecular Formula: C2H2BrN Molecular Weight (g/mol): 119.95 MDL Number: MFCD00001884 InChI Key: REXUYBKPWIPONM-UHFFFAOYSA-N Synonym: bromoacetonitrile,acetonitrile, bromo,bromomethyl cyanide,cyanomethyl bromide,ccris 6213,2-bromoethanenitrile,unii-07k08j16vk,bromacetonitrile,bromoacetonitile,bromo acetonitrile PubChem CID: 11534 IUPAC Name: 2-bromoacetonitrile SMILES: BrCC#N

PubChem CID 11534
CAS 590-17-0
Molecular Weight (g/mol) 119.95
MDL Number MFCD00001884
SMILES BrCC#N
Synonym bromoacetonitrile,acetonitrile, bromo,bromomethyl cyanide,cyanomethyl bromide,ccris 6213,2-bromoethanenitrile,unii-07k08j16vk,bromacetonitrile,bromoacetonitile,bromo acetonitrile
IUPAC Name 2-bromoacetonitrile
InChI Key REXUYBKPWIPONM-UHFFFAOYSA-N
Molecular Formula C2H2BrN
13

1-Bromo-2-methylpropane, 98+%

CAS: 78-77-3 Molecular Formula: C4H9Br Molecular Weight (g/mol): 137.02 InChI Key: HLVFKOKELQSXIQ-UHFFFAOYSA-N Synonym: isobutyl bromide,iso-butyl bromide,propane, 1-bromo-2-methyl,bromoisobutane,i-butyl bromide,1-bromo-2-methyl-propane,unii-5oec0bw987,ccris 349,1-bromo-2-methyl propane,bromoacetaldehydedimethylacetal PubChem CID: 6555 IUPAC Name: 1-bromo-2-methylpropane SMILES: CC(C)CBr

PubChem CID 6555
CAS 78-77-3
Molecular Weight (g/mol) 137.02
SMILES CC(C)CBr
Synonym isobutyl bromide,iso-butyl bromide,propane, 1-bromo-2-methyl,bromoisobutane,i-butyl bromide,1-bromo-2-methyl-propane,unii-5oec0bw987,ccris 349,1-bromo-2-methyl propane,bromoacetaldehydedimethylacetal
IUPAC Name 1-bromo-2-methylpropane
InChI Key HLVFKOKELQSXIQ-UHFFFAOYSA-N
Molecular Formula C4H9Br
14

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
15

1-(2-Bromoethyl)-4-ethyl-1,4-dihydro-5H-tetrazol-5-one, 95%

CAS: 84501-67-7 Molecular Formula: C5H9BrN4O Molecular Weight (g/mol): 221.058 MDL Number: MFCD16251259 InChI Key: KQKSCWCKLKLXJS-UHFFFAOYSA-N Synonym: 1-2-bromoethyl-4-ethyl-1,4-dihydro-5h-tetrazol-5-one,1-2-bromoethyl-4-ethyltetrazol-5-one,1-2-bromoethyl-4-ethyl-tetrazol-5-one,1-2-bromoethyl-4-ethyl-1,2,3,4-tetrazol-5-one,2-4-ethyl-4,5-dihydro-5-oxo-1h-tetrazol-1-yl ethyl bromide PubChem CID: 3019915 IUPAC Name: 1-(2-bromoethyl)-4-ethyltetrazol-5-one SMILES: CCN1C(=O)N(N=N1)CCBr

PubChem CID 3019915
CAS 84501-67-7
Molecular Weight (g/mol) 221.058
MDL Number MFCD16251259
SMILES CCN1C(=O)N(N=N1)CCBr
Synonym 1-2-bromoethyl-4-ethyl-1,4-dihydro-5h-tetrazol-5-one,1-2-bromoethyl-4-ethyltetrazol-5-one,1-2-bromoethyl-4-ethyl-tetrazol-5-one,1-2-bromoethyl-4-ethyl-1,2,3,4-tetrazol-5-one,2-4-ethyl-4,5-dihydro-5-oxo-1h-tetrazol-1-yl ethyl bromide
IUPAC Name 1-(2-bromoethyl)-4-ethyltetrazol-5-one
InChI Key KQKSCWCKLKLXJS-UHFFFAOYSA-N
Molecular Formula C5H9BrN4O