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CHEMICAL products beginning with : C
3251 to 3300 of 75457 results  Page: << Previous 50 Results 60 61 62 63 64 65 [66] 67 68 69 70 71 72 73 74 75 76 77 78 79 80 >> Next 50 Results
 PRODUCT NAMECAS Registry Number 
Cafestol palmitate (4 suppliers)
Compound Structure Synonyms: CCRIS 5878, CID133758, Hexadecanoic acid, (3b,4,5,6,7,8,9,10,10a,10b,11,12-dodecahydro-7-hydroxy-10b-methyl-5a,8-methano-5aH-cyclohepta(5,6)naphtho(2,1-b)furan-7-yl)methyl ester, (3bS-(3balpha,5abeta,7beta,8beta,10aalpha,10bbeta))-

Molecular Formula: C36H58O4Molecular Weight: 554.843320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DGPMHJKMSANHDM-XCPWRNKKSA-N

81760-46-5
Caffeic Acid (57 suppliers)
Compound Structure IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 331-39-5
Synonyms: caffeic acid, trans-Caffeate, 3,4-Dihydroxycinnamic acid, trans-caffeic acid, Caffeic acid polymer, Cinnamic acid, 3,4-dihydroxy-, 3,4-Dihydroxy-trans-cinnamate, CCRIS 847, 3,4-Dihydroxybenzeneacrylic acid, 3,4-Dihydroxy-cinnamic acid, HSDB 7088, MLS000069738, MLS001076493, C0625_SIGMA, SPECTRUM1503987, ARONIS023304, C9H8O4, NSC57197, 3-(3,4-Dihydroxyphenyl)propenoic acid, 60018_FLUKA

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QAIPRVGONGVQAS-DUXPYHPUSA-N

331-39-5
Caffeic Acid 3-?-D-Glucoside (7 suppliers)
Compound Structure IUPAC Name: (E)-3-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid | CAS Registry Number: 24959-81-7
Synonyms: Caffeic acid 3-glucoside, AC1NQZ0T, Caffeic Acid 3-|A-D-Glucoside, MolPort-019-936-829, FT-0664191, C10431, 3-(|A-D-Glucopyranosyloxy)-4-hydroxy-cinnamic Acid, 3-(|A-D-Glucopyranosyloxy)-4-hydroxycinnamic Acid, 3-[3-(|A-D-Glucopyranosyloxy)-4-hydroxyphenyl]-2-propenoic Acid, (E)-3-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

Molecular Formula: C15H18O9Molecular Weight: 342.298020 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: QOPSZFXPZWQLOG-VHCZEJTMSA-N

24959-81-7
Caffeic Acid 3-?-D-Glucuronide (7 suppliers)
Compound Structure IUPAC Name: (2S,3S,4S,5R,6S)-6-[5-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid | CAS Registry Number: 1093679-73-2
Synonyms: Caffeic Acid 3-|A-D-Glucuronide, 5-[(1E)-2-Carboxyethenyl]-2-hydroxyphenyl |A-D-Glucopyranosiduronic Acid

Molecular Formula: C15H16O10Molecular Weight: 356.281540 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: BSOMSDFTZKNUHY-ZYZFHZPYSA-N

1093679-73-2
Caffeic acid 3-methyl phenethyl ester (12 suppliers)
Compound Structure IUPAC Name: phenethyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | CAS Registry Number: 71835-85-3
Synonyms: Phenyethyl 3-methylcaffeate, Phenylethyl 3-methylcaffeate, Phenylethyl-3-methylcaffeate, CCRIS 7791, CHEBI:320757, MolPort-003-845-560, NSC666255, AIDS085221, AIDS-085221, NSC671193, ZINC01642021, CID5284444, LS-184855, .beta.-Phenylethyl 4-hydroxy-3-methoxycinnamate, 2-Phenylethyl 3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, 2-phenylethyl (2E)-3-[4-hydroxy-3-(methyloxy)phenyl]prop-2-enoate, 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 2-phenylethyl ester, 3-(4-Hydroxy-3-methoxy-phenyl)-acrylic acid phenethyl ester, (E)-3-(4-Hydroxy-3-methoxy-phenyl)-acrylic acid phenethyl ester

Molecular Formula: C18H18O4Molecular Weight: 298.333120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CZQNYPBIOHVQQN-CSKARUKUSA-N

71835-85-3
Caffeic Acid 4-?-D-Glucuronide (7 suppliers)
Compound Structure IUPAC Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid | CAS Registry Number: 1093679-71-0
Synonyms: Caffeic Acid 4-|A-D-Glucuronide, 4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenyl |A-D-Glucopyranosiduronic Acid

Molecular Formula: C15H16O10Molecular Weight: 356.281540 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: LTGOIJNQWZWJRF-ZYZFHZPYSA-N

1093679-71-0
Caffeic Acid Benzyl Ester-d5 (2 suppliers)
Compound Structure IUPAC Name: (2,3,4,5,6-pentadeuteriophenyl)methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 1331655-92-5

Molecular Formula: C16H14O4Molecular Weight: 275.310 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WWVKQTNONPWVEL-RALIUCGRSA-N

1331655-92-5
Caffeic acid dimethyl phenethyl ester (9 suppliers)
Compound Structure IUPAC Name: 2-phenylethyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate | CAS Registry Number: 145551-14-0
Synonyms: NSC666253, Phenethyl Dimethyl Caffeate, AC1NS4CK, CHEMBL133642, CHEBI:320736, ZINC01642020, Phenethyl 3,4-Dimethoxyphenylcinnamate, NSC 666253, NSC-666253, .beta.-Phenylethyl 3,4-dimethoxycinnamate, Caffeic Acid Dimethyl Ether Phenethyl Ester, FT-0664188, phenethyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate, 3-(3,4-Dimethoxyphenyl)-2-propenoic Acid 2-Phenylethyl Ester

Molecular Formula: C19H20O4Molecular Weight: 312.359700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OHBFHJOQNCVEOU-PKNBQFBNSA-N

145551-14-0
Caffeic acid glucopyranoside (1 supplier)13080-40-5
Caffeic acid methyl ester (17 suppliers)
Compound Structure IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 3843-74-1
Synonyms: Methyl caffeate, Methyl 3,4-dihydroxycinnamate, CHEBI:119183, MolPort-002-747-457, MolPort-004-959-644, AIDS085228, AIDS-085228, CID689075, ZINC00058222, methyl 3-(3,4-dihydroxyphenyl)acrylate, C-1420, C10477, 3-(3,4-Dihydroxy-phenyl)-acrylic acid methyl ester, (E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid methyl ester, A4212/0179337

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: OCNYGKNIVPVPPX-HWKANZROSA-N

3843-74-1
Caffeic acid Phenethyl Ester (10 suppliers)10594-70-9
Caffeic Acid Phenylethyl Ester (38 suppliers)
Compound Structure IUPAC Name: 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 104594-70-9
Synonyms: Phenethyl caffeate, Capeee, Caffeic acid phenethyl ester, CAPE, CAPE compound, Phenylethyl caffeate, Lopac0_000269, BSPBio_001560, BSPBio_003586, MLS000859889, C8221_SIGMA, SPECTRUM1502209, AIDS028600, AIDS-028600, ZINC00001083, Caffeic Acid Phenethyl Ester, Synthetic, IDI1_034030, QTL1_000016, NCGC00093727-01, NCGC00093727-02

Molecular Formula: C17H16O4Molecular Weight: 284.306540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-N

104594-70-9
Caffeic Acid-13C3 (8 suppliers)
Compound Structure IUPAC Name: 3-(3,4-dihydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 1185245-82-2
Synonyms: CTK8F8412

Molecular Formula: C9H8O4Molecular Weight: 183.135385 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QAIPRVGONGVQAS-CTEGUFHBSA-N

1185245-82-2
Caffeic acid-13C9 (2 suppliers)
Compound Structure IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 1173097-51-2
Synonyms: 3,4-Dihydroxycinnamic acid-13C9

Molecular Formula: C9H8O4Molecular Weight: 189.091314 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: QAIPRVGONGVQAS-RJKLISAOSA-N

1173097-51-2
CAFFEIC ACID-PYEEIE; N-[3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-ALLYL]-O-PHOSPHONO -L-TYROSYL-L-A-GLUTAMYL-L-A-GLUTAMYL-L-ISOLEUCYL-L-GLUTA MIC ACID (5 suppliers)
Compound Structure IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-4-carboxy-2-[[(2S)-4-carboxy-2-[[(2S)-2-[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]-3-(4-phosphonooxyphenyl)propanoyl]amino]butanoyl]amino]butanoyl]amino]-3-methylpentanoyl]amino]pentanedioic acid | CAS Registry Number: 507471-72-9
Synonyms: Caffeic acid-pYEEIE, MolPort-023-276-279, AKOS024456867, N-[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]-O-phosphono-L-tyrosyl-L-?-glutamyl-L-?-glutamyl-L-isoleucyl-L-glutamic acid

Molecular Formula: C39H50N5O19PMolecular Weight: 923.810162 [g/mol]
H-Bond Donor: 13H-Bond Acceptor: 19

InChIKey: OLKLXQPYJYPETQ-GYHHIBSGSA-N

507471-72-9
Caffeic anhydride (1 supplier)
Compound Structure IUPAC Name: [(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 854237-32-4
Synonyms: caffeic anhydride, SCHEMBL17372826, MolPort-039-338-760, ZINC85613220

Molecular Formula: C18H14O7Molecular Weight: 342.303 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: QDPOOGQUCJJZAO-FCXRPNKRSA-N

854237-32-4
CAFFEIDINE (13 suppliers)
Compound Structure IUPAC Name: N,3-dimethyl-5-(methylamino)imidazole-4-carboxamide | CAS Registry Number: 20041-90-1
Synonyms: Caffeidine, CID159880, 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-

Molecular Formula: C7H12N4OMolecular Weight: 168.196380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FNYXJOYPHLKLRW-UHFFFAOYSA-N

20041-90-1
CAFFEIDINE ACID (6 suppliers)554536-15-1
Caffeine (113 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 58-08-2
Synonyms: caffeine, Cafeina, Guaranine, Caffein, Koffein, Mateina, Methyltheobromine, Alert-pep, Thein, Cafipel, Theine, Caffedrine, Coffeine, Dexitac, Refresh'n, Stim, Methyltheobromide, Cafamil, Cafecon, Caffine

Molecular Formula: C8H10N4O2Molecular Weight: 194.190600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RYYVLZVUVIJVGH-UHFFFAOYSA-N

58-08-2
Caffeine - Impurity E (Nitrate Salt) (1 supplier)
Compound Structure IUPAC Name: N,3-dimethyl-5-(methylamino)imidazole-4-carboxamide;nitric acid | CAS Registry Number: 209725-34-8
Synonyms: Caffeidine Nitrate, N,3-dimethyl-5-(methylamino)imidazole-4-carboxamide;nitric acid, N,1-Dimethyl-4-(methylamino)-1H-imidazole-5-carboxamide Nitrate (Caffeidine Nitrate)

Molecular Formula: C7H13N5O4Molecular Weight: 231.210 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: XGFNYBSCQHXIQC-UHFFFAOYSA-N

209725-34-8
CAFFEINE ACETATE (5 suppliers)
Compound Structure IUPAC Name: acetic acid;1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 5743-16-8
Synonyms: SureCN6659248, CTK5A6857, AG-G-02616

Molecular Formula: C10H14N4O4Molecular Weight: 254.242560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: GINZSXZSGUKTSK-UHFFFAOYSA-N

5743-16-8
Caffeine acetyltryptophanate (1 supplier)53112-36-0
Caffeine Alkaloids (1 supplier)
CAFFEINE and SODIUM BENZOATE (3 suppliers)
Caffeine Anhydrous (1 supplier)
CAFFEINE ANHYDROUS, PHARMA (1 supplier)
CAFFEINE ASPARTATE (3 suppliers)
Compound Structure IUPAC Name: (2S)-2-aminobutanedioic acid;1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 52243-45-5
Synonyms: CTK4J5656, AG-F-77900

Molecular Formula: C12H17N5O6Molecular Weight: 327.293280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: ZOGVGYCIWMGUOZ-WNQIDUERSA-N

52243-45-5
CAFFEINE BENZOATE (4 suppliers)
Compound Structure IUPAC Name: benzoic acid; 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 5743-17-9
Synonyms: Caffeine benzoate, EINECS 227-257-3, C8H10N4O2.C7H6O2, CID64120, 8000-95-1 (hydrochloride salt), LS-175838

Molecular Formula: C15H16N4O4Molecular Weight: 316.311940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VXXKVQICUHMECR-UHFFFAOYSA-N

5743-17-9
Caffeine Citrate (2 suppliers)
Compound Structure IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 8003-10-9
Synonyms: Caffeine citrate, Caffeine, Citrated, Caffeina citrate, Citrated caffein, 69-22-7, Caffeine citrate (1:1), UNII-U26EO4675Q, NCGC00015208-09, Citric acid, compd. with caffeine (1:1), DSSTox_CID_26938, DSSTox_RID_82023, DSSTox_GSID_46938, 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, CAS-69-22-7, caffeine; citro, 1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione; 2-hydroxypropane-1,2,3-tricarboxylic acid, Caffeine (citrated), Cafcit (TN), CAFFEINECITRATED, Caffeine citrate (USP)

Molecular Formula: C14H18N4O9Molecular Weight: 386.314120 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: RCQXSQPPHJPGOF-UHFFFAOYSA-N

8003-10-9
Caffeine Citrate Oral Solution 10mg/ml (0 suppliers)
CAFFEINE DIMER (2 suppliers)138455-22-8
Caffeine EP Impurity E HCl (1 supplier)2019-08-5
CAFFEINE GLUTAMATE (3 suppliers)
Compound Structure IUPAC Name: (2S)-2-aminopentanedioic acid;1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 52243-43-3
Synonyms: CTK4J5655, AG-F-77899

Molecular Formula: C13H19N5O6Molecular Weight: 341.319860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: BDVCIWDTUSHERV-HVDRVSQOSA-N

52243-43-3
Caffeine Granular (1 supplier)
CAFFEINE HCL (7 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethyl-7H-purin-7-ium-2,6-dione chloride | CAS Registry Number: 5892-18-2
Synonyms: Caffeine, hydrochloride, Caffeine monohydrochloride, Caffeine monohydrochloride (8CI), EINECS 227-570-5, CID22181, LS-48581, 3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione monohydrochloride, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, monohydrochloride, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, monohydrochloride (9CI)

Molecular Formula: C8H11ClN4O2Molecular Weight: 230.651540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VDHPYBVMFNLZQG-UHFFFAOYSA-N

5892-18-2
CAFFEINE HYDROBROMIDE (4 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethyl-7H-purin-7-ium-2,6-dione bromide | CAS Registry Number: 5743-18-0
Synonyms: Caffeine bromide, Caffeine hydrobromide, CAFFEINE, MONOHYDROBROMIDE, EINECS 227-258-9, CID21966, LS-48598, 3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, monohydrobromide, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, monohydrobromide, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, monohydrobromide (9CI)

Molecular Formula: C8H11BrN4O2Molecular Weight: 275.102540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: XXSSHQCOBPQFOL-UHFFFAOYSA-N

5743-18-0
Caffeine Impurity E HCl (2 suppliers)
Compound Structure IUPAC Name: N,3-dimethyl-5-(methylamino)imidazole-4-carboxamide;hydrochloride | CAS Registry Number: 107605-95-8
Synonyms: 1H-Imidazole-5-carboxamide, N,1-dimethyl-4-(methylamino)-, hydrochloride (1:1)

Molecular Formula: C7H13ClN4OMolecular Weight: 204.660 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: HJEDZGNFLRWVQH-UHFFFAOYSA-N

107605-95-8
CAFFEINE MONO(HYDROGEN TRIIODIDE) (2 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethyl-9H-purin-7-ium-2,6-dione triiodide | CAS Registry Number: 5968-71-8
Synonyms: CAFFEINE TRIIODIDE

Molecular Formula: C8H11I3N4O2Molecular Weight: 575.911950 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SVDNZUIMOSTKAO-UHFFFAOYSA-O

5968-71-8
CAFFEINE MONOHYDRATE (6 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethylpurine-2,6-dione hydrate | CAS Registry Number: 5743-12-4
Synonyms: caffeine, Caffeine (TN), Caffeine monohydrate, Caffeine (JP15), 1,3,7-Trimethylxanthine, CHEBI:31332, CID64119, D01453, 3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione monohydrate, 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione hydrate, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-, monohydrate, 58-08-2

Molecular Formula: C8H12N4O3Molecular Weight: 212.205880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LCHGOKZNRDAXEK-UHFFFAOYSA-N

5743-12-4
CAFFEINE MONOHYDRIODIDE (3 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethyl-7H-purin-7-ium-2,6-dione iodide | CAS Registry Number: 17135-90-9
Synonyms: Caffeine, hydriodide, Caffeine hydroiodide, CAFFEINE, MONOHYDRIODIDE, CID28309, LS-48597

Molecular Formula: C8H11IN4O2Molecular Weight: 322.103010 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KBOPLBWQIZNEFF-UHFFFAOYSA-N

17135-90-9
CAFFEINE SALICYLATE (4 suppliers)
Compound Structure IUPAC Name: 2-hydroxybenzoic acid; 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 5743-22-6
Synonyms: Caffeine salicylate, CID64121, EINECS 227-259-4, NSC144074, Salicylic acid, compd. with caffeine (1:1), Benzoic acid, 2-hydroxy-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1)

Molecular Formula: C15H16N4O5Molecular Weight: 332.311340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SVXXBCDDJXZXOZ-UHFFFAOYSA-N

5743-22-6
Caffeine Sodium Benzoate (5 suppliers)
Compound Structure IUPAC Name: sodium 1,3,7-trimethylpurine-2,6-dione benzoate | CAS Registry Number: 8000-95-1
Synonyms: Annaca, Caffeine sodium benzoate, Caffeine benzoate sodium, Sodium caffeine benzoate, Caffeine sodium benzoicum, Sodium benzoate and caffeine, caffeine benzoate, sodium salt, CAFFEINE and SODIUM BENZOATE, C8H10N4O2.C7H5O2.Na, LS-48602, Benzoic acid, sodium salt, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, 5743-17-9, Benzoic acid, sodium salt, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (9CI)

Molecular Formula: C15H15N4NaO4Molecular Weight: 338.293770 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: JWBPVFVNISJVEM-UHFFFAOYSA-M

8000-95-1
CAFFEINE SODIUM SALICYLATE (3 suppliers)
Compound Structure IUPAC Name: sodium; 2-hydroxybenzoate; 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 8002-85-5
Synonyms: Caffeine sodium salicylate, Caffeine-sodium salicylate mixture, CID24664, Sodium salicylate, compd. with caffeine, LS-37641, Sodium salicylate, compd. with caffeine (7CI), Benzoic acid, 2-hydroxy-, monosodium salt, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione

Molecular Formula: C15H15N4NaO5Molecular Weight: 354.293170 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: MJZVAJZDKMFTBN-UHFFFAOYSA-M

8002-85-5
Caffeine Synthetic (0 suppliers)
CAFFEINE, [1-METHYL-14C] (2 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 77196-81-7
Synonyms: (14-C)Caffeine, Caffeine-1-methyl-14C, AC1L20IO, AC1Q3Z21, 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-1-(methyl-14C)-

Molecular Formula: C8H10N4O2Molecular Weight: 196.183142 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RYYVLZVUVIJVGH-YZRHJBSPSA-N

77196-81-7
CAFFEINE, [TRIMETHYL-13C3] (4 suppliers)
Compound Structure IUPAC Name: 1,3,7-tri(methyl)purine-2,6-dione | CAS Registry Number: 78072-66-9
Synonyms: Caffeine-13C3 solution, Caffeine-trimethyl-13C3, Caffeine-trimethyl-13C3 solution, Caffeine-(trimethyl-13C3), 485365_ALDRICH, 603295_ALDRICH, CTK8F8414, 603295_FLUKA, AG-H-13152, CAFFEINE-13C3;CAFFEINE (TRIMETHYL-13C3);CAFFEINE-TRIMETHYL-13C3, 99 ATOM % 13C;Caffeine-13C3 solution;Caffeine-trimethyl-13C3 solution

Molecular Formula: C8H10N4O2Molecular Weight: 197.168565 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RYYVLZVUVIJVGH-VMIGTVKRSA-N

78072-66-9
Caffeine, Citrated (6 suppliers)
Compound Structure IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 69-22-7
Synonyms: Caffeine citrate, Cafcit, Caffeina citrate, Citrated caffein, Caffeine (citrated), Cafcit (TN), Caffeine citrate (1:1), Caffeine citrate (USP), Caffeine, citrated [USAN], C8H10N4O2.C6H8O7, CAFFEINE, CITRATE (1:1), NSC63248, Citric acid, compd. with caffeine (1:1), LS-121085, D07603, 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, 2406-91-9, 8003-10-9

Molecular Formula: C14H18N4O9Molecular Weight: 386.314120 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: RCQXSQPPHJPGOF-UHFFFAOYSA-N

69-22-7
CAFFEINE, PHARMA (0 suppliers)
CAFFEINE,8-BENZYL- (3 suppliers)
Compound Structure IUPAC Name: 8-benzyl-1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 5426-88-0
Synonyms: 8-Benzyl-caffeine, CAFFEINE, 8-BENZYL-, Oprea1_300507, MLS000737468, NSC14396, CHEBI:592670, NSC 14396, CID21551, BRN 0298246, ZINC01652984, LS-48569, SMR000528153, 4-26-00-02535 (Beilstein Handbook Reference), 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-(phenylmethyl)-, 8-benzyl-1,3,7-trimethyl-3,4,5,7-tetrahydro-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-1,3, 7-trimethyl-8- (phenylmethyl)-, 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-(phenylmethyl)- (9CI)

Molecular Formula: C15H16N4O2Molecular Weight: 284.313140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YWCYMEPBJYACMO-UHFFFAOYSA-N

5426-88-0
Caffeine-(3-methyl-13C) (3 suppliers)
Compound Structure IUPAC Name: 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 202282-98-2
Synonyms: [13C1]-Caffeine, 1H-Purine-2,6-dione, 3,7-dihydro-1,7-dimethyl-3-(methyl-13C)- (9CI)

Molecular Formula: C8H10N4O2Molecular Weight: 195.183255 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RYYVLZVUVIJVGH-VQEHIDDOSA-N

202282-98-2
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