Caffeine Sodium Benzoate
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Product Description
Product
Caffeine Sodium Benzoate
CAS
8000-95-1
Formula
C15H15N4NaO4; C8H10N4O2.C7H5O2.Na
Synonym
Caffeine sodium benzoate; Caffeine sodium benzoicum; CAFFEINE-SODIUM BENZOATE; COFFEINE SODIUM BENZOATE; GUARANINE SODIUM BENZOATE; METHYLTHEOBROMINE SODIUM BENZOATE; Sodium benzoate and caffeine; Sodium caffeine benzoate; 1,3,7-TRIMETHYL-2,6-DIOXOPURINE SODIUM BENZOATE; 1,3,7-TRIMETHYLXANTHINE SODIUM BENZOATE; Annaca; Benzoic acid, sodium salt, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (9CI); Caffeine and sodium benzoate; Caffeine benzoate sodium
Typical Product Specifications
Molecular weight
338.29
SMILES
c12c(n(c(n(c1=O)C)=O)C)ncn2C.c1(ccccc1)C(=O)[O-].[Na+]
InChI
JWBPVFVNISJVEM-UHFFFAOYSA-M
InChIKey
1S/C8H10N4O2.C7H6O2.Na/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;8-7(9)6-4-2-1-3-5-6;/h4H,1-3H3;1-5H,(H,8,9);/q;;+1/p-1
Class
Caffeine Sodium Benzoate
Product Description
Product
Caffeine Sodium Benzoate
CAS
8000-95-1
Formula
C15H15N4NaO4; C8H10N4O2.C7H5O2.Na
Synonym
Caffeine sodium benzoate; Caffeine sodium benzoicum; CAFFEINE-SODIUM BENZOATE; COFFEINE SODIUM BENZOATE; GUARANINE SODIUM BENZOATE; METHYLTHEOBROMINE SODIUM BENZOATE; Sodium benzoate and caffeine; Sodium caffeine benzoate; 1,3,7-TRIMETHYL-2,6-DIOXOPURINE SODIUM BENZOATE; 1,3,7-TRIMETHYLXANTHINE SODIUM BENZOATE; Annaca; Benzoic acid, sodium salt, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (9CI); Caffeine and sodium benzoate; Caffeine benzoate sodium
Typical Product Specifications
Molecular weight
338.29
SMILES
c12c(n(c(n(c1=O)C)=O)C)ncn2C.c1(ccccc1)C(=O)[O-].[Na+]
InChI
JWBPVFVNISJVEM-UHFFFAOYSA-M
InChIKey
1S/C8H10N4O2.C7H6O2.Na/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;8-7(9)6-4-2-1-3-5-6;/h4H,1-3H3;1-5H,(H,8,9);/q;;+1/p-1
Class
