Copper Benzene-1,3,5-tricarboxylate
CAS #: N/A
Product Code : ECu-A140-CU-CU
CAS #: N/A
Linear Formula: C18H6Cu3O12
MDL Number: MFCD10567003
EC No.: N/A
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Synonyms
CU-BTC MOF, CU(BTC), Cu3(BTC)2, MOF CUBTC, HKUST-1, copper trimesate, copper(II) benzene-1, 3, 5-tricarboxylate, copper benzenetricarboxylate, Copper(2+) 1, 3, 5-benzenetricarboxylate (3:2), tricopper benzene-1, 3, 5-tricarboxylate, 1, 3, 5-Benzenetricarboxylic acid, copper salt, 51937-85-0, Basolite C300
Compound Formula: C18H6Cu3O12
Molecular Weight: 604.87
Appearance: Blue powder
Melting Point: N/A
Boiling Point: N/A
Density: N/A
Solubility in H2O: N/A
Exact Mass: 602.775 g/mol
Monoisotopic Mass: 602.775 g/mol
Bulk Density: 0.35 g/cm3
Specific Surface Area: 1500-2100 m2/g (BET)
Health & Safety Information
Signal Word: Danger
Hazard Statements: H301-H315-H319-H410
Hazard Codes: Xn, N
Risk Codes: 22-36/38-50/53
Safety Statements: 26-61
RTECS Number: N/A
Transport Information: UN 3077 9 / PG 3
WGK Germany: 3
Chemical Identifiers
Linear Formula: C18H6Cu3O12
Pubchem CID: 18380918
MDL Number: MFCD10567003
EC No.: N/A
IUPAC Name: tricopper; benzene-1,3,5-tricarboxylate
Beilstein/Reaxys No.: N/A
SMILES: C1=C(C=C(C=C1C(=O)[O-])C(=O)[O-])C(=O)[O-].C1=C(C=C(C=C1C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cu+2].[Cu+2].[Cu+2]
InchI Identifier: InChI=1S/2C9H6O6.3Cu/c2*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;;/h2*1-3H,(H,10,11)(H,12,13)(H,14,15);;;/q;;3*+2/p-6
InchI Key: NOSIKKRVQUQXEJ-UHFFFAOYSA-H