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Aralkylamines

Organic compounds that consist of an alkylamine in which the alkyl group is substituted by an aromatic functional group.
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1

Ritalinic Acid 98.0+%, TCI America™

CAS: 19395-41-6 Molecular Formula: C13H17NO2 Molecular Weight (g/mol): 219.284 MDL Number: MFCD06200695 InChI Key: INGSNVSERUZOAK-UHFFFAOYSA-N Synonym: 2-Phenyl-2-(2-piperidyl)acetic Acid PubChem CID: 86863 ChEBI: CHEBI:83481 IUPAC Name: 2-phenyl-2-piperidin-2-ylacetic acid SMILES: C1CCNC(C1)C(C2=CC=CC=C2)C(=O)O

PubChem CID 86863
CAS 19395-41-6
Molecular Weight (g/mol) 219.284
ChEBI CHEBI:83481
MDL Number MFCD06200695
SMILES C1CCNC(C1)C(C2=CC=CC=C2)C(=O)O
Synonym 2-Phenyl-2-(2-piperidyl)acetic Acid
IUPAC Name 2-phenyl-2-piperidin-2-ylacetic acid
InChI Key INGSNVSERUZOAK-UHFFFAOYSA-N
Molecular Formula C13H17NO2
2

5-(1-Piperidinylmethyl)thiophene-2-boronic acid pinacol ester, Thermo Scientific Chemicals

CAS: 1218790-44-3 Molecular Formula: C16H26BNO2S Molecular Weight (g/mol): 307.259 MDL Number: MFCD11113036 InChI Key: KDPVLCCGXRCQCV-UHFFFAOYSA-N Synonym: 5-1-piperidinylmethyl thiophene-2-boronic acid pinacol ester,1-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl piperidine,5-piperidine methyl-2-thiopheneboronic acid pinacol ester,1-5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl piperidine,amtb125,5-piperidinomethyl-2-thiopheneboronic acid pinacol ester,5-1-piperidinylmethyl-thiophene-2-boronic acid pinacol ester,1-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-thiophen-2-ylmethyl-piperidine PubChem CID: 46739745 IUPAC Name: 1-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methyl]piperidine SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(S2)CN3CCCCC3

PubChem CID 46739745
CAS 1218790-44-3
Molecular Weight (g/mol) 307.259
MDL Number MFCD11113036
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CC=C(S2)CN3CCCCC3
Synonym 5-1-piperidinylmethyl thiophene-2-boronic acid pinacol ester,1-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl piperidine,5-piperidine methyl-2-thiopheneboronic acid pinacol ester,1-5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl piperidine,amtb125,5-piperidinomethyl-2-thiopheneboronic acid pinacol ester,5-1-piperidinylmethyl-thiophene-2-boronic acid pinacol ester,1-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-thiophen-2-ylmethyl-piperidine
IUPAC Name 1-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methyl]piperidine
InChI Key KDPVLCCGXRCQCV-UHFFFAOYSA-N
Molecular Formula C16H26BNO2S
3

Porphobilinogen monohydrate, MP Biomedicals™

CAS: 487-90-1 Molecular Formula: C10H14N2O4 Molecular Weight (g/mol): 226.232 InChI Key: QSHWIQZFGQKFMA-UHFFFAOYSA-N Synonym: porphobilinogen,unii-74khc72qxk,3-5-aminomethyl-4-carboxymethyl-1h-pyrrol-3-yl propanoic acid,1h-pyrrole-3-propanoic acid, 5-aminomethyl-4-carboxymethyl,2-aminomethylpyrrol-3-acetic acid 4-propionic acid,74khc72qxk,pbg,5-aminomethyl-4-carboxymethyl-1h-pyrrole-3-propanoic acid,5-aminomethyl-4-carboxymethyl-1h-pyrrole-3-propionic acid,5-aminomethyl-4-carboxymethyl-pyrrole-3-propionic acid PubChem CID: 1021 ChEBI: CHEBI:17381 IUPAC Name: 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid SMILES: C1=C(C(=C(N1)CN)CC(=O)O)CCC(=O)O

PubChem CID 1021
CAS 487-90-1
Molecular Weight (g/mol) 226.232
ChEBI CHEBI:17381
SMILES C1=C(C(=C(N1)CN)CC(=O)O)CCC(=O)O
Synonym porphobilinogen,unii-74khc72qxk,3-5-aminomethyl-4-carboxymethyl-1h-pyrrol-3-yl propanoic acid,1h-pyrrole-3-propanoic acid, 5-aminomethyl-4-carboxymethyl,2-aminomethylpyrrol-3-acetic acid 4-propionic acid,74khc72qxk,pbg,5-aminomethyl-4-carboxymethyl-1h-pyrrole-3-propanoic acid,5-aminomethyl-4-carboxymethyl-1h-pyrrole-3-propionic acid,5-aminomethyl-4-carboxymethyl-pyrrole-3-propionic acid
IUPAC Name 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid
InChI Key QSHWIQZFGQKFMA-UHFFFAOYSA-N
Molecular Formula C10H14N2O4
4

4-{[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)thien-2-yl]methyl}morpholine, 97%, Thermo Scientific™

CAS: 364794-85-4 Molecular Formula: C15H24BNO3S Molecular Weight (g/mol): 309.23 MDL Number: MFCD11841079 InChI Key: AMUMGAXTCHBNPU-UHFFFAOYSA-N Synonym: 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thien-2-ylmethyl morpholine,4-4-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl morpholine,4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl morpholine,2-morpholin-4-ylmethyl thiophene-4-boronic acid, pinacol ester,4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thien-2-yl methyl morpholine,amtb834,2-morpholin-4-ylmethyl thiophene-4-boronic acid pinacol ester,2-morpholin-4-ylmethyl thiophene-4-boronic acid,pinacol ester PubChem CID: 23438311 IUPAC Name: 4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methyl]morpholine SMILES: CC1(C)OB(OC1(C)C)C1=CSC(CN2CCOCC2)=C1

PubChem CID 23438311
CAS 364794-85-4
Molecular Weight (g/mol) 309.23
MDL Number MFCD11841079
SMILES CC1(C)OB(OC1(C)C)C1=CSC(CN2CCOCC2)=C1
Synonym 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thien-2-ylmethyl morpholine,4-4-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl morpholine,4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thiophen-2-yl methyl morpholine,2-morpholin-4-ylmethyl thiophene-4-boronic acid, pinacol ester,4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl thien-2-yl methyl morpholine,amtb834,2-morpholin-4-ylmethyl thiophene-4-boronic acid pinacol ester,2-morpholin-4-ylmethyl thiophene-4-boronic acid,pinacol ester
IUPAC Name 4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methyl]morpholine
InChI Key AMUMGAXTCHBNPU-UHFFFAOYSA-N
Molecular Formula C15H24BNO3S
5

Betahistine Methanesulfonate 99.0+%, TCI America™

CAS: 54856-23-4 Molecular Formula: C10H20N2O6S2 Molecular Weight (g/mol): 328.398 MDL Number: MFCD00143688 InChI Key: ZBJJDYGJCNTNTH-UHFFFAOYSA-N Synonym: Betahistine Mesylate, 2-[2-(Methylamino)ethyl]pyridine Methanesulfonate PubChem CID: 198334 IUPAC Name: methanesulfonic acid;N-methyl-2-pyridin-2-ylethanamine SMILES: CNCCC1=CC=CC=N1.CS(=O)(=O)O.CS(=O)(=O)O

PubChem CID 198334
CAS 54856-23-4
Molecular Weight (g/mol) 328.398
MDL Number MFCD00143688
SMILES CNCCC1=CC=CC=N1.CS(=O)(=O)O.CS(=O)(=O)O
Synonym Betahistine Mesylate, 2-[2-(Methylamino)ethyl]pyridine Methanesulfonate
IUPAC Name methanesulfonic acid;N-methyl-2-pyridin-2-ylethanamine
InChI Key ZBJJDYGJCNTNTH-UHFFFAOYSA-N
Molecular Formula C10H20N2O6S2
6

5-Aminomethyl-2-(Boc-amino)pyridine, 97%

CAS: 187237-37-2 Molecular Formula: C11H17N3O2 Molecular Weight (g/mol): 223.276 MDL Number: MFCD07781132 InChI Key: DFLQTVPEIMTXSZ-UHFFFAOYSA-N Synonym: 2-boc-amino-5-aminomethyl pyridine,5-aminomethyl-2-n-boc aminopyridine,tert-butyl 5-aminomethyl pyridin-2-yl carbamate,tert-butyl 5-aminomethyl pyridin-2-ylcarbamate,tert-butyl n-5-aminomethyl pyridin-2-yl carbamate,5-aminomethyl-pyridin-2-yl-carbamic acid tert-butyl ester,5-aminomethyl-2-boc-amino pyridine,carbamic acid,n-5-aminomethyl-2-pyridinyl-, 1,1-dimethylethyl ester,2-tert-butoxycarbonyl-amino-5-aminomethylpyridine PubChem CID: 42553118 IUPAC Name: tert-butyl N-[5-(aminomethyl)pyridin-2-yl]carbamate SMILES: CC(C)(C)OC(=O)NC1=NC=C(C=C1)CN

PubChem CID 42553118
CAS 187237-37-2
Molecular Weight (g/mol) 223.276
MDL Number MFCD07781132
SMILES CC(C)(C)OC(=O)NC1=NC=C(C=C1)CN
Synonym 2-boc-amino-5-aminomethyl pyridine,5-aminomethyl-2-n-boc aminopyridine,tert-butyl 5-aminomethyl pyridin-2-yl carbamate,tert-butyl 5-aminomethyl pyridin-2-ylcarbamate,tert-butyl n-5-aminomethyl pyridin-2-yl carbamate,5-aminomethyl-pyridin-2-yl-carbamic acid tert-butyl ester,5-aminomethyl-2-boc-amino pyridine,carbamic acid,n-5-aminomethyl-2-pyridinyl-, 1,1-dimethylethyl ester,2-tert-butoxycarbonyl-amino-5-aminomethylpyridine
IUPAC Name tert-butyl N-[5-(aminomethyl)pyridin-2-yl]carbamate
InChI Key DFLQTVPEIMTXSZ-UHFFFAOYSA-N
Molecular Formula C11H17N3O2
7

Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine 97.0+%, TCI America™

CAS: 510758-28-8 Molecular Formula: C30H30N10 Molecular Weight (g/mol): 530.64 MDL Number: MFCD09265124 InChI Key: WKGZJBVXZWCZQC-UHFFFAOYSA-N Synonym: tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta PubChem CID: 11203363 IUPAC Name: tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine SMILES: C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1

PubChem CID 11203363
CAS 510758-28-8
Molecular Weight (g/mol) 530.64
MDL Number MFCD09265124
SMILES C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1
Synonym tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta
IUPAC Name tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine
InChI Key WKGZJBVXZWCZQC-UHFFFAOYSA-N
Molecular Formula C30H30N10
8

Ranitidine hydrochloride, 99%

CAS: 66357-59-3 Molecular Formula: C13H23ClN4O3S Molecular Weight (g/mol): 350.862 MDL Number: MFCD00069339 InChI Key: GGWBHVILAJZWKJ-CHHCPSLASA-N Synonym: ranitidine hydrochloride,noctone,n-2-5-dimethylamino methyl-2-furanyl methyl thio ethyl-n'-methyl-2-nitro-1,1-ethanediamine hydrochloride,c13h22n4o3s.hcl,opera_id_624,melfax hydrochloride,zantac hydrochloride,zintac hydrochloride,azantac hydrochloride,raniben hydrochloride PubChem CID: 6603542 IUPAC Name: (Z)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine;hydrochloride SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C.Cl

PubChem CID 6603542
CAS 66357-59-3
Molecular Weight (g/mol) 350.862
MDL Number MFCD00069339
SMILES CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C.Cl
Synonym ranitidine hydrochloride,noctone,n-2-5-dimethylamino methyl-2-furanyl methyl thio ethyl-n'-methyl-2-nitro-1,1-ethanediamine hydrochloride,c13h22n4o3s.hcl,opera_id_624,melfax hydrochloride,zantac hydrochloride,zintac hydrochloride,azantac hydrochloride,raniben hydrochloride
IUPAC Name (Z)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine;hydrochloride
InChI Key GGWBHVILAJZWKJ-CHHCPSLASA-N
Molecular Formula C13H23ClN4O3S
9

Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine, 97+%

CAS: 510758-28-8 Molecular Formula: C30H30N10 Molecular Weight (g/mol): 530.64 MDL Number: MFCD09265124 InChI Key: WKGZJBVXZWCZQC-UHFFFAOYSA-N Synonym: tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta PubChem CID: 11203363 IUPAC Name: 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine SMILES: C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1

PubChem CID 11203363
CAS 510758-28-8
Molecular Weight (g/mol) 530.64
MDL Number MFCD09265124
SMILES C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1
Synonym tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta
IUPAC Name 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine
InChI Key WKGZJBVXZWCZQC-UHFFFAOYSA-N
Molecular Formula C30H30N10
10

Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine, 97%

CAS: 510758-28-8 Molecular Formula: C30H30N10 Molecular Weight (g/mol): 530.64 MDL Number: MFCD09265124 InChI Key: WKGZJBVXZWCZQC-UHFFFAOYSA-N Synonym: tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta PubChem CID: 11203363 IUPAC Name: 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine SMILES: C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1

PubChem CID 11203363
CAS 510758-28-8
Molecular Weight (g/mol) 530.64
MDL Number MFCD09265124
SMILES C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1
Synonym tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta
IUPAC Name 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine
InChI Key WKGZJBVXZWCZQC-UHFFFAOYSA-N
Molecular Formula C30H30N10
11

Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine, 97%

CAS: 510758-28-8 Molecular Formula: C30H30N10 Molecular Weight (g/mol): 530.64 MDL Number: MFCD09265124 InChI Key: WKGZJBVXZWCZQC-UHFFFAOYSA-N Synonym: tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta PubChem CID: 11203363 IUPAC Name: 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine SMILES: C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1

PubChem CID 11203363
CAS 510758-28-8
Molecular Weight (g/mol) 530.64
MDL Number MFCD09265124
SMILES C(N(CC1=CN(CC2=CC=CC=C2)N=N1)CC1=CN(CC2=CC=CC=C2)N=N1)C1=CN(CC2=CC=CC=C2)N=N1
Synonym tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine,1,2,4-trimethyl-5-benzenesulfonic acid,tris 1-benzyl-1h-1,2,3-triazole-4-ylmethyl amine,tris 1-benzyl-1h-1,2,3-triazol-4-yl methyl amine tbta
IUPAC Name 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine
InChI Key WKGZJBVXZWCZQC-UHFFFAOYSA-N
Molecular Formula C30H30N10
12

1-Naphthalenemethylamine, 97%

CAS: 118-31-0 Molecular Formula: C11H12N Molecular Weight (g/mol): 158.22 MDL Number: MFCD00004048 InChI Key: NVSYANRBXPURRQ-UHFFFAOYSA-O Synonym: 1-naphthalenemethylamine,1-naphthalenemethanamine,1-naphthylmethylamine,1-aminomethyl naphthalene,1-naphthalenemethyl amine,c-naphthalen-1-yl-methylamine,1-naphthylmethanamine,1-aminomethylnaphthalene,naphthylmethylamine,1-naphthylmethyl amine hydrochloride PubChem CID: 8355 IUPAC Name: naphthalen-1-ylmethanamine SMILES: [NH3+]CC1=C2C=CC=CC2=CC=C1

PubChem CID 8355
CAS 118-31-0
Molecular Weight (g/mol) 158.22
MDL Number MFCD00004048
SMILES [NH3+]CC1=C2C=CC=CC2=CC=C1
Synonym 1-naphthalenemethylamine,1-naphthalenemethanamine,1-naphthylmethylamine,1-aminomethyl naphthalene,1-naphthalenemethyl amine,c-naphthalen-1-yl-methylamine,1-naphthylmethanamine,1-aminomethylnaphthalene,naphthylmethylamine,1-naphthylmethyl amine hydrochloride
IUPAC Name naphthalen-1-ylmethanamine
InChI Key NVSYANRBXPURRQ-UHFFFAOYSA-O
Molecular Formula C11H12N