Organoheterocyclic compounds
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2-Methyl-1,3-thiazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 35272-15-2 Molecular Formula: C5H5NO2S Molecular Weight (g/mol): 143.16 MDL Number: MFCD03407332 InChI Key: ZHDRDZMTEOIWSX-UHFFFAOYSA-N Synonym: 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid PubChem CID: 284728 IUPAC Name: 2-methyl-1,3-thiazole-4-carboxylic acid SMILES: CC1=NC(=CS1)C(=O)O
| PubChem CID | 284728 |
|---|---|
| CAS | 35272-15-2 |
| Molecular Weight (g/mol) | 143.16 |
| MDL Number | MFCD03407332 |
| SMILES | CC1=NC(=CS1)C(=O)O |
| Synonym | 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid |
| IUPAC Name | 2-methyl-1,3-thiazole-4-carboxylic acid |
| InChI Key | ZHDRDZMTEOIWSX-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2S |
1,2-Bis(4-pyridyl)ethane, 97%
CAS: 4916-57-8 Molecular Formula: C12H12N2 Molecular Weight (g/mol): 184.24 MDL Number: MFCD00006451 InChI Key: DQRKTVIJNCVZAX-UHFFFAOYSA-N Synonym: 1,2-bis 4-pyridyl ethane,1,2-di pyridin-4-yl ethane,4,4'-ethylenedipyridine,1,2-di 4-pyridyl ethane,4,4'-ethane-1,2-diyldipyridine,unii-wo1evc302b,pyridine, 4,4'-1,2-ethanediyl bis,wo1evc302b,chembl70083,4-2-pyridin-4-ylethyl pyridine PubChem CID: 78630 IUPAC Name: 4-(2-pyridin-4-ylethyl)pyridine SMILES: C1=CN=CC=C1CCC2=CC=NC=C2
| PubChem CID | 78630 |
|---|---|
| CAS | 4916-57-8 |
| Molecular Weight (g/mol) | 184.24 |
| MDL Number | MFCD00006451 |
| SMILES | C1=CN=CC=C1CCC2=CC=NC=C2 |
| Synonym | 1,2-bis 4-pyridyl ethane,1,2-di pyridin-4-yl ethane,4,4'-ethylenedipyridine,1,2-di 4-pyridyl ethane,4,4'-ethane-1,2-diyldipyridine,unii-wo1evc302b,pyridine, 4,4'-1,2-ethanediyl bis,wo1evc302b,chembl70083,4-2-pyridin-4-ylethyl pyridine |
| IUPAC Name | 4-(2-pyridin-4-ylethyl)pyridine |
| InChI Key | DQRKTVIJNCVZAX-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2 |
Methyl 4-(1H-imidazol-1-ylmethyl)benzoate, 97%, Thermo Scientific™
CAS: 160446-18-4 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD00608318 InChI Key: HMWIIHIOSBESMH-UHFFFAOYSA-N Synonym: methyl 4-1h-imidazol-1-ylmethyl benzoate,methyl 4-imidazol-1-ylmethyl benzoate,methyl 4-1h-imidazol-1-yl methyl benzoate,methyl 4-imidazolylmethyl benzoate,4-imidazol-1-ylmethyl-benzoic acid methyl ester,4-1h-imidazol-1-ylmethyl benzoic acid methyl ester,benzoicacid, 4-1h-imidazol-1-ylmethyl-, methyl ester PubChem CID: 3164140 IUPAC Name: methyl 4-(imidazol-1-ylmethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)CN2C=CN=C2
| PubChem CID | 3164140 |
|---|---|
| CAS | 160446-18-4 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD00608318 |
| SMILES | COC(=O)C1=CC=C(C=C1)CN2C=CN=C2 |
| Synonym | methyl 4-1h-imidazol-1-ylmethyl benzoate,methyl 4-imidazol-1-ylmethyl benzoate,methyl 4-1h-imidazol-1-yl methyl benzoate,methyl 4-imidazolylmethyl benzoate,4-imidazol-1-ylmethyl-benzoic acid methyl ester,4-1h-imidazol-1-ylmethyl benzoic acid methyl ester,benzoicacid, 4-1h-imidazol-1-ylmethyl-, methyl ester |
| IUPAC Name | methyl 4-(imidazol-1-ylmethyl)benzoate |
| InChI Key | HMWIIHIOSBESMH-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O2 |
4,4,5,5-Tetramethyl-2-[2-(phenoxymethyl)phenyl]-1,3,2-dioxaborolane, 97%, Thermo Scientific™
CAS: 912569-55-2 Molecular Formula: C19H23BO3 Molecular Weight (g/mol): 310.20 MDL Number: MFCD09064986 InChI Key: DTPMFYHICLWUGJ-UHFFFAOYSA-N Synonym: 4,4,5,5-tetramethyl-2-2-phenoxymethyl phenyl-1,3,2-dioxaborolane PubChem CID: 24229585 IUPAC Name: 4,4,5,5-tetramethyl-2-[2-(phenoxymethyl)phenyl]-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC=C1COC1=CC=CC=C1
| PubChem CID | 24229585 |
|---|---|
| CAS | 912569-55-2 |
| Molecular Weight (g/mol) | 310.20 |
| MDL Number | MFCD09064986 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC=CC=C1COC1=CC=CC=C1 |
| Synonym | 4,4,5,5-tetramethyl-2-2-phenoxymethyl phenyl-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[2-(phenoxymethyl)phenyl]-1,3,2-dioxaborolane |
| InChI Key | DTPMFYHICLWUGJ-UHFFFAOYSA-N |
| Molecular Formula | C19H23BO3 |
5-Bromo-2-chloro-6-methylpyridine, 98%
CAS: 132606-40-7 Molecular Formula: C6H5BrClN Molecular Weight (g/mol): 206.47 MDL Number: MFCD07375117 InChI Key: DTFBHJWQTDQBEM-UHFFFAOYSA-N Synonym: 5-bromo-2-chloro-6-methylpyridine,3-bromo-6-chloro-2-picoline,3-bromo-6-chloro-2-methyl-pyridine,5-bromo-2-chloro-6-picoline,2-chloro-5-bromo-6-methylpyridine,2-chloro-6-methyl-5-bromopyridine,pyridine, 3-bromo-6-chloro-2-methyl,2-chloro-5-bromo-6-picoline,pubchem6208 PubChem CID: 14866674 IUPAC Name: 3-bromo-6-chloro-2-methylpyridine SMILES: CC1=C(Br)C=CC(Cl)=N1
| PubChem CID | 14866674 |
|---|---|
| CAS | 132606-40-7 |
| Molecular Weight (g/mol) | 206.47 |
| MDL Number | MFCD07375117 |
| SMILES | CC1=C(Br)C=CC(Cl)=N1 |
| Synonym | 5-bromo-2-chloro-6-methylpyridine,3-bromo-6-chloro-2-picoline,3-bromo-6-chloro-2-methyl-pyridine,5-bromo-2-chloro-6-picoline,2-chloro-5-bromo-6-methylpyridine,2-chloro-6-methyl-5-bromopyridine,pyridine, 3-bromo-6-chloro-2-methyl,2-chloro-5-bromo-6-picoline,pubchem6208 |
| IUPAC Name | 3-bromo-6-chloro-2-methylpyridine |
| InChI Key | DTFBHJWQTDQBEM-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrClN |
2-Fluoropyridine-4-boronic acid, 98%
CAS: 401815-98-3 Molecular Formula: C5H5BFNO2 Molecular Weight (g/mol): 140.91 MDL Number: MFCD04112534 InChI Key: WXGBZJJAGLSBPR-UHFFFAOYSA-N Synonym: 2-fluoropyridine-4-boronic acid,2-fluoropyridin-4-yl boronic acid,2-fluoro-4-pyridineboronic acid,2-fluoro-4-pyridinylboronic acid,2-fluoropyridine-4-boronicacid,2-fluoropyridin-4-yl-4-boronic acid,2-fluoropyridine-boronic acid,2-fluoro-4-pyridyl boronic acid,2-fluoro-pyridine-4-boronic acid,boronic acid, 2-fluoro-4-pyridinyl PubChem CID: 2783396 IUPAC Name: (2-fluoropyridin-4-yl)boronic acid SMILES: OB(O)C1=CC=NC(F)=C1
| PubChem CID | 2783396 |
|---|---|
| CAS | 401815-98-3 |
| Molecular Weight (g/mol) | 140.91 |
| MDL Number | MFCD04112534 |
| SMILES | OB(O)C1=CC=NC(F)=C1 |
| Synonym | 2-fluoropyridine-4-boronic acid,2-fluoropyridin-4-yl boronic acid,2-fluoro-4-pyridineboronic acid,2-fluoro-4-pyridinylboronic acid,2-fluoropyridine-4-boronicacid,2-fluoropyridin-4-yl-4-boronic acid,2-fluoropyridine-boronic acid,2-fluoro-4-pyridyl boronic acid,2-fluoro-pyridine-4-boronic acid,boronic acid, 2-fluoro-4-pyridinyl |
| IUPAC Name | (2-fluoropyridin-4-yl)boronic acid |
| InChI Key | WXGBZJJAGLSBPR-UHFFFAOYSA-N |
| Molecular Formula | C5H5BFNO2 |
2,5-Dihydroxy-1,4-dithiane, 96%
CAS: 40018-26-6 Molecular Formula: C4H8O2S2 Molecular Weight (g/mol): 152.226 MDL Number: MFCD00006659 InChI Key: YUIOPHXTILULQC-UHFFFAOYSA-N Synonym: p-dithiane-2,5-diol,2,5-dihydroxy-1,4-dithiane,mercaptoacetaldehyde dimer,4-dithiane-2,5-diol,1,4 dithiane-2,5-diol,2,5-dihydroxy-1,4-dithian,p-dthane-2,5-dol,pubchem20480,1,4dithiane-2,5diol,acmc-1anme PubChem CID: 98330 IUPAC Name: 1,4-dithiane-2,5-diol SMILES: C1C(SCC(S1)O)O
| PubChem CID | 98330 |
|---|---|
| CAS | 40018-26-6 |
| Molecular Weight (g/mol) | 152.226 |
| MDL Number | MFCD00006659 |
| SMILES | C1C(SCC(S1)O)O |
| Synonym | p-dithiane-2,5-diol,2,5-dihydroxy-1,4-dithiane,mercaptoacetaldehyde dimer,4-dithiane-2,5-diol,1,4 dithiane-2,5-diol,2,5-dihydroxy-1,4-dithian,p-dthane-2,5-dol,pubchem20480,1,4dithiane-2,5diol,acmc-1anme |
| IUPAC Name | 1,4-dithiane-2,5-diol |
| InChI Key | YUIOPHXTILULQC-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2S2 |
2-Thiopheneboronic acid, 97%
CAS: 6165-68-0 Molecular Formula: C4H5BO2S Molecular Weight (g/mol): 127.95 MDL Number: MFCD00151850 InChI Key: ARYHTUPFQTUBBG-UHFFFAOYSA-N Synonym: thiophene-2-boronic acid,2-thiopheneboronic acid,2-thienylboronic acid,thienylboronic acid,2-thiopheneboronicacid,thiophen-2-ylboranediol,thiophene2-boronic acid,thiophen-2-yl boronic acid,2-thiophenylboric acid,boronic acid, thienyl PubChem CID: 2733960 IUPAC Name: thiophen-2-ylboronic acid SMILES: OB(O)C1=CC=CS1
| PubChem CID | 2733960 |
|---|---|
| CAS | 6165-68-0 |
| Molecular Weight (g/mol) | 127.95 |
| MDL Number | MFCD00151850 |
| SMILES | OB(O)C1=CC=CS1 |
| Synonym | thiophene-2-boronic acid,2-thiopheneboronic acid,2-thienylboronic acid,thienylboronic acid,2-thiopheneboronicacid,thiophen-2-ylboranediol,thiophene2-boronic acid,thiophen-2-yl boronic acid,2-thiophenylboric acid,boronic acid, thienyl |
| IUPAC Name | thiophen-2-ylboronic acid |
| InChI Key | ARYHTUPFQTUBBG-UHFFFAOYSA-N |
| Molecular Formula | C4H5BO2S |
2-Morpholino-5-(trifluoromethyl)benzoic acid, 97%, Thermo Scientific™
CAS: 865471-20-1 Molecular Formula: C12H12F3NO3 Molecular Weight (g/mol): 275.227 MDL Number: MFCD09025883 InChI Key: PRECFTDWCNEEDB-UHFFFAOYSA-N Synonym: 2-morpholino-5-trifluoromethyl benzoic acid,2-morpholin-4-yl-5-trifluoromethyl benzoic acid,benzoic acid,2-4-morpholinyl-5-trifluoromethyl PubChem CID: 24229572 IUPAC Name: 2-morpholin-4-yl-5-(trifluoromethyl)benzoic acid SMILES: C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)C(=O)O
| PubChem CID | 24229572 |
|---|---|
| CAS | 865471-20-1 |
| Molecular Weight (g/mol) | 275.227 |
| MDL Number | MFCD09025883 |
| SMILES | C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)C(=O)O |
| Synonym | 2-morpholino-5-trifluoromethyl benzoic acid,2-morpholin-4-yl-5-trifluoromethyl benzoic acid,benzoic acid,2-4-morpholinyl-5-trifluoromethyl |
| IUPAC Name | 2-morpholin-4-yl-5-(trifluoromethyl)benzoic acid |
| InChI Key | PRECFTDWCNEEDB-UHFFFAOYSA-N |
| Molecular Formula | C12H12F3NO3 |
Tetrahydropyran-2-ylmethylamine, 97%, Thermo Scientific™
CAS: 683233-12-7 Molecular Formula: C6H14ClNO Molecular Weight (g/mol): 151.634 MDL Number: MFCD06738971 InChI Key: NGHRATGQJXKQIQ-UHFFFAOYSA-N Synonym: oxan-2-ylmethanamine hydrochloride,tetrahydropyran-2-ylmethylamine hydrochloride,c-tetrahydro-pyran-2-yl-methylamine hydrochloride,oxan-2-yl methanamine hydrochloride,tetrahydro-2h-pyran-2-yl methanamine hydrochloride,tetrahydro-2h-pyran-2-ylmethyl amine hydrochloride,tetrahydro-2h-pyran-2-yl methyl amine hydrochloride,2-aminomethyltetrahydropyran hydrochloride,tetrahydro-pyran-2-ylmethylamine hcl,1-oxan-2-yl methanamine hydrochloride PubChem CID: 43811037 IUPAC Name: oxan-2-ylmethanamine;hydrochloride SMILES: C1CCOC(C1)CN.Cl
| PubChem CID | 43811037 |
|---|---|
| CAS | 683233-12-7 |
| Molecular Weight (g/mol) | 151.634 |
| MDL Number | MFCD06738971 |
| SMILES | C1CCOC(C1)CN.Cl |
| Synonym | oxan-2-ylmethanamine hydrochloride,tetrahydropyran-2-ylmethylamine hydrochloride,c-tetrahydro-pyran-2-yl-methylamine hydrochloride,oxan-2-yl methanamine hydrochloride,tetrahydro-2h-pyran-2-yl methanamine hydrochloride,tetrahydro-2h-pyran-2-ylmethyl amine hydrochloride,tetrahydro-2h-pyran-2-yl methyl amine hydrochloride,2-aminomethyltetrahydropyran hydrochloride,tetrahydro-pyran-2-ylmethylamine hcl,1-oxan-2-yl methanamine hydrochloride |
| IUPAC Name | oxan-2-ylmethanamine;hydrochloride |
| InChI Key | NGHRATGQJXKQIQ-UHFFFAOYSA-N |
| Molecular Formula | C6H14ClNO |
5-Amino-3-methylisoxazole, 98%
CAS: 14678-02-5 Molecular Formula: C4H6N2O Molecular Weight (g/mol): 98.105 MDL Number: MFCD00003151 InChI Key: FNXYWHTZDAVRTB-UHFFFAOYSA-N Synonym: 5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine PubChem CID: 84590 IUPAC Name: 3-methyl-1,2-oxazol-5-amine SMILES: CC1=NOC(=C1)N
| PubChem CID | 84590 |
|---|---|
| CAS | 14678-02-5 |
| Molecular Weight (g/mol) | 98.105 |
| MDL Number | MFCD00003151 |
| SMILES | CC1=NOC(=C1)N |
| Synonym | 5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine |
| IUPAC Name | 3-methyl-1,2-oxazol-5-amine |
| InChI Key | FNXYWHTZDAVRTB-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2O |
2-(3-Bromopropoxy)tetrahydro-2H-pyran, 98%, stabilized with potassium carbonate, Thermo Scientific Chemicals
CAS: 33821-94-2 Molecular Formula: C8H15BrO2 Molecular Weight (g/mol): 223.1 InChI Key: HJNHUFQGDJLQRS-UHFFFAOYSA-N Synonym: 2-3-bromopropoxy tetrahydro-2h-pyran,2-3-bromopropoxy oxane,2-3-bromopropoxy-tetrahydro-2h-pyran,2-3-bromopropoxy tetrahydropyran,1-bromo-3-tetrahydropyranyloxypropane,2-3-bromo-propoxy-tetrahydro-pyran,2h-pyran, 2-3-bromopropoxy tetrahydro,acmc-1cjr6,1-bromo-3-2-oxanyloxy propane PubChem CID: 2777988 IUPAC Name: 2-(3-bromopropoxy)oxane SMILES: C1CCOC(C1)OCCCBr
| PubChem CID | 2777988 |
|---|---|
| CAS | 33821-94-2 |
| Molecular Weight (g/mol) | 223.1 |
| SMILES | C1CCOC(C1)OCCCBr |
| Synonym | 2-3-bromopropoxy tetrahydro-2h-pyran,2-3-bromopropoxy oxane,2-3-bromopropoxy-tetrahydro-2h-pyran,2-3-bromopropoxy tetrahydropyran,1-bromo-3-tetrahydropyranyloxypropane,2-3-bromo-propoxy-tetrahydro-pyran,2h-pyran, 2-3-bromopropoxy tetrahydro,acmc-1cjr6,1-bromo-3-2-oxanyloxy propane |
| IUPAC Name | 2-(3-bromopropoxy)oxane |
| InChI Key | HJNHUFQGDJLQRS-UHFFFAOYSA-N |
| Molecular Formula | C8H15BrO2 |
Biphenyl-4-boronic acid pinacol ester, 97%
CAS: 144432-80-4 Molecular Formula: C18H21BO2 Molecular Weight (g/mol): 280.17 MDL Number: MFCD07368291 InChI Key: REDKQKNJWVIPIO-UHFFFAOYSA-N Synonym: 4-biphenylboronic acid pinacol ester,2-1,1'-biphenyl-4-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-4-biphenylyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-biphenylboronic acid, pinacol ester,4,4,5,5-tetramethyl-2-4-phenylphenyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 2-1,1'-biphenyl-4-yl-4,4,5,5-tetramethyl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl biphenyl,2-biphenyl-4-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl diphenyl PubChem CID: 11989651 IUPAC Name: 4,4,5,5-tetramethyl-2-(4-phenylphenyl)-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 11989651 |
|---|---|
| CAS | 144432-80-4 |
| Molecular Weight (g/mol) | 280.17 |
| MDL Number | MFCD07368291 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-biphenylboronic acid pinacol ester,2-1,1'-biphenyl-4-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-4-biphenylyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-biphenylboronic acid, pinacol ester,4,4,5,5-tetramethyl-2-4-phenylphenyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 2-1,1'-biphenyl-4-yl-4,4,5,5-tetramethyl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl biphenyl,2-biphenyl-4-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl diphenyl |
| IUPAC Name | 4,4,5,5-tetramethyl-2-(4-phenylphenyl)-1,3,2-dioxaborolane |
| InChI Key | REDKQKNJWVIPIO-UHFFFAOYSA-N |
| Molecular Formula | C18H21BO2 |
1-(4-Piperidyl)-1H-1,2,3-benzotriazole hydrochloride, ≥90%, Thermo Scientific™
CAS: 79098-80-9 Molecular Formula: C11H15ClN4 Molecular Weight (g/mol): 238.719 MDL Number: MFCD00831110 InChI Key: SIZIQJKLJZWLLD-UHFFFAOYSA-N Synonym: 1-4-piperidyl-1h-1,2,3-benzotriazole hydrochloride,1-piperidin-4-ylbenzotriazole hydrochloride,1-piperidin-4-yl benzotriazole hydrochloride,1-piperidin-4-yl-1h-benzotriazole hydrochloride,1-piperidin-4-yl-1,2,3-benzotriazole hydrochloride,c11h14n4.hcl,4-piperidylbenzotriazole, chloride,4-benzotriazol-1-yl-piperidine hcl salt,4-benzotriazol-1-ylpiperidine hydrochloride,1-4-piperidinyl benzotriazole hydrochloride PubChem CID: 2779380 IUPAC Name: 1-piperidin-4-ylbenzotriazole;hydrochloride SMILES: C1CNCCC1N2C3=CC=CC=C3N=N2.Cl
| PubChem CID | 2779380 |
|---|---|
| CAS | 79098-80-9 |
| Molecular Weight (g/mol) | 238.719 |
| MDL Number | MFCD00831110 |
| SMILES | C1CNCCC1N2C3=CC=CC=C3N=N2.Cl |
| Synonym | 1-4-piperidyl-1h-1,2,3-benzotriazole hydrochloride,1-piperidin-4-ylbenzotriazole hydrochloride,1-piperidin-4-yl benzotriazole hydrochloride,1-piperidin-4-yl-1h-benzotriazole hydrochloride,1-piperidin-4-yl-1,2,3-benzotriazole hydrochloride,c11h14n4.hcl,4-piperidylbenzotriazole, chloride,4-benzotriazol-1-yl-piperidine hcl salt,4-benzotriazol-1-ylpiperidine hydrochloride,1-4-piperidinyl benzotriazole hydrochloride |
| IUPAC Name | 1-piperidin-4-ylbenzotriazole;hydrochloride |
| InChI Key | SIZIQJKLJZWLLD-UHFFFAOYSA-N |
| Molecular Formula | C11H15ClN4 |
4-(Pyrrolidin-1-ylmethyl)benzoic acid, 97%, Thermo Scientific™
CAS: 159691-25-5 Molecular Formula: C12H15NO2 Molecular Weight (g/mol): 205.257 InChI Key: DOEIPZUTRVMWAB-UHFFFAOYSA-N Synonym: 4-pyrrolidin-1-ylmethyl benzoic acid,4-pyrrolidin-1-ylmethyl-benzoic acid,4-pyrrolidin-1-yl methyl benzoic acid,4-pyrrolidinylmethyl benzoic acid,4-pyrrolidin-1-ylmethyl-benzoicacid,4-1-pyrrolidinylmethyl-benzoic acid,benzoic acid, 4-1-pyrrolidinylmethyl-, hydrochloride PubChem CID: 1092976 IUPAC Name: 4-(pyrrolidin-1-ylmethyl)benzoic acid SMILES: C1CCN(C1)CC2=CC=C(C=C2)C(=O)O
| PubChem CID | 1092976 |
|---|---|
| CAS | 159691-25-5 |
| Molecular Weight (g/mol) | 205.257 |
| SMILES | C1CCN(C1)CC2=CC=C(C=C2)C(=O)O |
| Synonym | 4-pyrrolidin-1-ylmethyl benzoic acid,4-pyrrolidin-1-ylmethyl-benzoic acid,4-pyrrolidin-1-yl methyl benzoic acid,4-pyrrolidinylmethyl benzoic acid,4-pyrrolidin-1-ylmethyl-benzoicacid,4-1-pyrrolidinylmethyl-benzoic acid,benzoic acid, 4-1-pyrrolidinylmethyl-, hydrochloride |
| IUPAC Name | 4-(pyrrolidin-1-ylmethyl)benzoic acid |
| InChI Key | DOEIPZUTRVMWAB-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO2 |