4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride

C142H185B2BrCl3N19O17 — CID 158538106

About 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride

4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride (PubChem CID 158538106) has the molecular formula C142H185B2BrCl3N19O17 and a molecular weight of 2638.04 g/mol. Its IUPAC name is 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride.

Molecular Properties

• Compound Name: 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride
• PubChem CID: 158538106
• Molecular Formula: C142H185B2BrCl3N19O17
• Molecular Weight: 2638.04 g/mol
• Exact Mass: 2634.26
• IUPAC Name: 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride
• SMILES: C.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.Cc1ccc(Br)cc1Cl.Cc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1Cl.Cc1ccc(C2=CCN(C(=O)c3cccnc3)CC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cc1ccc(C2=CCNCC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cl.Cn1c(=O)n(CC(C)(C)C)c2ccc(B(O)O)nc21.O=C(O)c1cccnc1
• InChI: InChI=1S/C30H33N5O2.C29H38N4O3.C24H30N4O.C17H22ClNO2.C16H28BNO4.C12H18BN3O3.C7H6BrCl.C6H5NO2.CH4.ClH/c1-20-8-9-22(21-12-15-34(16-13-21)28(36)23-7-6-14-31-18-23)17-24(20)25-10-11-26-27(32-25)33(5)29(37)35(26)19-30(2,3)4;1-19-9-10-21(20-13-15-32(16-14-20)27(35)36-29(5,6)7)17-22(19)23-11-12-24-25(30-23)31(8)26(34)33(24)18-28(2,3)4;1-16-6-7-18(17-10-12-25-13-11-17)14-19(16)20-8-9-21-22(26-20)27(5)23(29)28(21)15-24(2,3)4;1-12-5-6-14(11-15(12)18)13-7-9-19(10-8-13)16(20)21-17(2,3)4;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-12(2,3)7-16-8-5-6-9(13(18)19)14-10(8)15(4)11(16)17;1-5-2-3-6(8)4-7(5)9;8-6(9)5-2-1-3-7-4-5;;/h6-12,14,17-18H,13,15-16,19H2,1-5H3;9-13,17H,14-16,18H2,1-8H3;6-10,14,25H,11-13,15H2,1-5H3;5-7,11H,8-10H2,1-4H3;8H,9-11H2,1-7H3;5-6,18-19H,7H2,1-4H3;2-4H,1H3;1-4H,(H,8,9);1H4;1H
• InChIKey: RXKQCWHKLYCNIX-UHFFFAOYSA-N
• XLogP: 27.56
• TPSA: 402.24 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 15
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2638.04
LogP ≤ 5	27.56
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride?

The IUPAC name of 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride (CID 158538106) is 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride.

What is the SMILES notation for 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride?

The canonical SMILES for 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride is C.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.Cc1ccc(Br)cc1Cl.Cc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1Cl.Cc1ccc(C2=CCN(C(=O)c3cccnc3)CC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cc1ccc(C2=CCNCC2)cc1-c1ccc2c(n1)n(C)c(=O)n2CC(C)(C)C.Cl.Cn1c(=O)n(CC(C)(C)C)c2ccc(B(O)O)nc21.O=C(O)c1cccnc1.

What is the InChIKey of 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride?

The InChIKey is RXKQCWHKLYCNIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33N5O2.C29H38N4O3.C24H30N4O.C17H22ClNO2.C16H28BNO4.C12H18BN3O3.C7H6BrCl.C6H5NO2.CH4.ClH/c1-20-8-9-22(21-12-15-34(16-13-21)28(36)23-7-6-14-31-18-23)17-24(20)25-10-11-26-27(32-25)33(5)29(37)35(26)19-30(2,3)4;1-19-9-10-21(20-13-15-32(16-14-20)27(35)36-29(5,6)7)17-22(19)23-11-12-24-25(30-23)31(8)26(34)33(24)18-28(2,3)4;1-16-6-7-18(17-10-12-25-13-11-17)14-19(16)20-8-9-21-22(26-20)27(5)23(29)28(21)15-24(2,3)4;1-12-5-6-14(11-15(12)18)13-7-9-19(10-8-13)16(20)21-17(2,3)4;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-12(2,3)7-16-8-5-6-9(13(18)19)14-10(8)15(4)11(16)17;1-5-2-3-6(8)4-7(5)9;8-6(9)5-2-1-3-7-4-5;;/h6-12,14,17-18H,13,15-16,19H2,1-5H3;9-13,17H,14-16,18H2,1-8H3;6-10,14,25H,11-13,15H2,1-5H3;5-7,11H,8-10H2,1-4H3;8H,9-11H2,1-7H3;5-6,18-19H,7H2,1-4H3;2-4H,1H3;1-4H,(H,8,9);1H4;1H.

What are the key properties of 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride?

4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride has a molecular weight of 2638.04 g/mol, XLogP of 27.56, 15 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 4-bromo-2-chloro-1-methylbenzene;tert-butyl 4-(3-chloro-4-methylphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-4-methylphenyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-[1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]imidazo[4,5-b]pyridin-2-one;1-(2,2-dimethylpropyl)-3-methyl-5-[2-methyl-5-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]imidazo[4,5-b]pyridin-2-one;[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]boronic acid;methane;pyridine-3-carboxylic acid;hydrochloride is sourced from PubChem (CID 158538106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).