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Tolcapone structure, CAS 134308-13-7

Tolcapone

CAS Number134308-13-7

SynonymsUNII-CIF6334OLY; 1-(3,4-dihydroxy-5-nitrophenyl)-1-(4-methylphenyl)methanone; tolcapone; tolcapone [INN_en]; 3,4-Dihydroxy-4'-methyl-5-nitrobenzophenone; 4'-methyl-3,4-dihydroxy-5-nitro-benzophenone; Tasmar (TN); MFCD00866569; Methanone,(3,4-dihydroxy-5-nitrophenyl)(4-methylphenyl); Tasmar; (3,4-Dihydroxy-5-nitrophenyl)(4-methylphenyl)methanone; Ro 40-7592

Molecular FormulaC14H11NO5

Molecular Weight273.24

Purity98%

Density1.4±0.1 g/cm3

Boiling Point485.6±45.0 °C at 760 mmHg

Melting Point126-128ºC

Flash Point

Appearance

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Cat. No.: 2A-0201107 Purity: 98%
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Quality Control of [ 134308-13-7 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number134308-13-7
Catalog No.2A-0201107
Chinese Name托卡朋
SynonymsUNII-CIF6334OLY; 1-(3,4-dihydroxy-5-nitrophenyl)-1-(4-methylphenyl)methanone; tolcapone; tolcapone [INN_en]; 3,4-Dihydroxy-4'-methyl-5-nitrobenzophenone; 4'-methyl-3,4-dihydroxy-5-nitro-benzophenone; Tasmar (TN); MFCD00866569; Methanone,(3,4-dihydroxy-5-nitrophenyl)(4-methylphenyl); Tasmar; (3,4-Dihydroxy-5-nitrophenyl)(4-methylphenyl)methanone; Ro 40-7592
Molecular FormulaC14H11NO5
Molecular Weight273.24
Purity98
Density1.4±0.1 g/cm3
Boiling Point485.6±45.0 °C at 760 mmHg
Melting Point126-128ºC
Storage Condition-20°C Freezer
ApplicationTolcapone (Ro 40-7592) is an orally active peripheral and central COMT inhibitor.
PubChem ID329751344
MDL NumberMFCD00866569
SMILESCc1ccc(cc1)C(=O)c2cc(O)c(O)c(c2)[N+]([O-])=O
InChI1S/C14H11NO5/c1-8-2-4-9(5-3-8)13(17)10-6-11(15(19)20)14(18)12(16)7-10/h2-7,16,18H,1H3
InChI KeyMIQPIUSUKVNLNT-UHFFFAOYSA-N
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/12764_1_134308_13_7.pdf
Transport InfoProduct name: Tocapone
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