2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate

C92H94BBr5Cl3F34N27O14 — CID 158854262

About 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate

2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate (PubChem CID 158854262) has the molecular formula C92H94BBr5Cl3F34N27O14 and a molecular weight of 2964.56 g/mol. Its IUPAC name is 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate.

Molecular Properties

• Compound Name: 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate
• PubChem CID: 158854262
• Molecular Formula: C92H94BBr5Cl3F34N27O14
• Molecular Weight: 2964.56 g/mol
• Exact Mass: 2957.20
• IUPAC Name: 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate
• SMILES: C.C.C.C.C.C.C.CC1(C)OB(c2cnc(OCC(F)(F)F)c(F)c2)OC1(C)C.CCOC(F)(F)c1nnc2cnc(-c3cnc(OCC(F)(F)F)c(F)c3)cn12.Clc1cnc(Br)cn1.Fc1cc(-c2cn3c(C(F)(F)Br)nnc3cn2)cnc1OCC(F)(F)F.Fc1cc(-c2cnc(Cl)cn2)cnc1OCC(F)(F)F.NNc1cnc(-c2cnc(OCC(F)(F)F)c(F)c2)cn1.O.O=C(CNc1cnc(-c2cnc(OCC(F)(F)F)c(F)c2)cn1)C(F)(F)Br.O=C(Cl)C(F)(F)Br.O=C(O)C(F)(F)Br.[H]/N=N/[H].[H][H]
• InChI: InChI=1S/C15H11F6N5O2.C14H9BrF6N4O2.C13H16BF4NO3.C13H6BrF6N5O.C11H6ClF4N3O.C11H9F4N5O.C4H2BrClN2.C2BrClF2O.C2HBrF2O2.7CH4.H2N2.H2O.H2/c1-2-28-15(20,21)13-25-24-11-5-22-10(6-26(11)13)8-3-9(16)12(23-4-8)27-7-14(17,18)19;15-14(20,21)10(26)4-24-11-5-22-9(3-23-11)7-1-8(16)12(25-2-7)27-6-13(17,18)19;1-11(2)12(3,4)22-14(21-11)8-5-9(15)10(19-6-8)20-7-13(16,17)18;14-13(19,20)11-24-23-9-3-21-8(4-25(9)11)6-1-7(15)10(22-2-6)26-5-12(16,17)18;12-9-4-17-8(3-18-9)6-1-7(13)10(19-2-6)20-5-11(14,15)16;12-7-1-6(8-3-18-9(20-16)4-17-8)2-19-10(7)21-5-11(13,14)15;5-3-1-8-4(6)2-7-3;3-2(5,6)1(4)7;3-2(4,5)1(6)7;;;;;;;;1-2;;/h3-6H,2,7H2,1H3;1-3,5H,4,6H2,(H,23,24);5-6H,7H2,1-4H3;1-4H,5H2;1-4H,5H2;1-4H,5,16H2,(H,18,20);1-2H;;(H,6,7);7*1H4;1-2H;1H2;1H/b;;;;;;;;;;;;;;;;2-1+
• InChIKey: BVCHFVMIGSFROK-MOIKPPNHSA-N
• XLogP: 27.45
• TPSA: 550.41 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 39
• Rotatable Bonds: 29
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2964.56
LogP ≤ 5	27.45
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate?

The IUPAC name of 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate (CID 158854262) is 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate.

What is the SMILES notation for 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate?

The canonical SMILES for 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate is C.C.C.C.C.C.C.CC1(C)OB(c2cnc(OCC(F)(F)F)c(F)c2)OC1(C)C.CCOC(F)(F)c1nnc2cnc(-c3cnc(OCC(F)(F)F)c(F)c3)cn12.Clc1cnc(Br)cn1.Fc1cc(-c2cn3c(C(F)(F)Br)nnc3cn2)cnc1OCC(F)(F)F.Fc1cc(-c2cnc(Cl)cn2)cnc1OCC(F)(F)F.NNc1cnc(-c2cnc(OCC(F)(F)F)c(F)c2)cn1.O.O=C(CNc1cnc(-c2cnc(OCC(F)(F)F)c(F)c2)cn1)C(F)(F)Br.O=C(Cl)C(F)(F)Br.O=C(O)C(F)(F)Br.[H]/N=N/[H].[H][H].

What is the InChIKey of 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate?

The InChIKey is BVCHFVMIGSFROK-MOIKPPNHSA-N. The full InChI is InChI=1S/C15H11F6N5O2.C14H9BrF6N4O2.C13H16BF4NO3.C13H6BrF6N5O.C11H6ClF4N3O.C11H9F4N5O.C4H2BrClN2.C2BrClF2O.C2HBrF2O2.7CH4.H2N2.H2O.H2/c1-2-28-15(20,21)13-25-24-11-5-22-10(6-26(11)13)8-3-9(16)12(23-4-8)27-7-14(17,18)19;15-14(20,21)10(26)4-24-11-5-22-9(3-23-11)7-1-8(16)12(25-2-7)27-6-13(17,18)19;1-11(2)12(3,4)22-14(21-11)8-5-9(15)10(19-6-8)20-7-13(16,17)18;14-13(19,20)11-24-23-9-3-21-8(4-25(9)11)6-1-7(15)10(22-2-6)26-5-12(16,17)18;12-9-4-17-8(3-18-9)6-1-7(13)10(19-2-6)20-5-11(14,15)16;12-7-1-6(8-3-18-9(20-16)4-17-8)2-19-10(7)21-5-11(13,14)15;5-3-1-8-4(6)2-7-3;3-2(5,6)1(4)7;3-2(4,5)1(6)7;;;;;;;;1-2;;/h3-6H,2,7H2,1H3;1-3,5H,4,6H2,(H,23,24);5-6H,7H2,1-4H3;1-4H,5H2;1-4H,5H2;1-4H,5,16H2,(H,18,20);1-2H;;(H,6,7);7*1H4;1-2H;1H2;1H/b;;;;;;;;;;;;;;;;2-1+;;.

What are the key properties of 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate?

2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate has a molecular weight of 2964.56 g/mol, XLogP of 27.45, 29 rotatable bonds, 6 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-5-chloropyrazine;2-bromo-2,2-difluoroacetic acid;2-bromo-2,2-difluoroacetyl chloride;1-bromo-1,1-difluoro-3-[[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]amino]propan-2-one;3-[bromo(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;2-chloro-5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazine;diazene;3-[ethoxy(difluoro)methyl]-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethoxy)pyridine;[5-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazin-2-yl]hydrazine;methane;molecular hydrogen;hydrate is sourced from PubChem (CID 158854262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).