NCS
中国新化学物质查询
预苯酸 钡盐(Prephenic acid barium salt)
1-羧基-4-羟基-alpha-氧代-2,5-环己二烯-1-丙酸钡
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1-羧基-4-羟基-α-氧代-2,5-环己二烯-1-丙酸, prephenic acid barium, (1-Carboxy-4t-hydroxy-cyclohexa-2,5-dien-r-yl)-brenztraubensaeure,Barium-Salz, (1-carboxy-4t-hydroxy-cyclohexa-2,5-dien-r-yl)-pyruvic acid,barium salt, barium prephenate
CAS号: 2931-08-0
IUPAC名称: barium(2+);1-(2-carboxylato-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylate
分子式: C10H8BaO6
分子量: 361.49400
InChI: InChI=1S/C10H10O6.Ba/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14;/h1-4,6,11H,5H2,(H,13,14)(H,15,16);/q;+2/p-2
InChIKey: XXHDQWSGCJPALI-UHFFFAOYSA-L
SMILES: C1=CC(C=CC1O)(CC(=O)C(=O)[O-])C(=O)[O-].[Ba+2]
EINECS: -
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