Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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3,421 – 3,435 of 202,906 results

3,421

Eflornithine Hydrochloride Monohydrate 98.0+%, TCI America™

CAS: 96020-91-6 Molecular Formula: C6H15ClF2N2O3 Molecular Weight (g/mol): 236.64 MDL Number: MFCD00242734 InChI Key: FJPAMFNRCFEGSD-UHFFFAOYNA-N Synonym: DL-alpha-Difluoromethylornithine Hydrochloride PubChem CID: 441361 IUPAC Name: hydrogen 2,5-diamino-2-(difluoromethyl)pentanoic acid hydrate chloride SMILES: [H+].O.[Cl-].NCCCC(N)(C(F)F)C(O)=O

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Specifications

PubChem CID	441361
CAS	96020-91-6
Molecular Weight (g/mol)	236.64
MDL Number	MFCD00242734
SMILES	[H+].O.[Cl-].NCCCC(N)(C(F)F)C(O)=O
Synonym	DL-alpha-Difluoromethylornithine Hydrochloride
IUPAC Name	hydrogen 2,5-diamino-2-(difluoromethyl)pentanoic acid hydrate chloride
InChI Key	FJPAMFNRCFEGSD-UHFFFAOYNA-N
Molecular Formula	C6H15ClF2N2O3

3,422

GlcNAc beta(1-3)[GlcNAc beta(1-6)]GalNAc-alpha-Thr 94.0+%, TCI America™

CAS: 1304646-03-4 Molecular Formula: C28H48N4O18 Molecular Weight (g/mol): 728.702 InChI Key: HWIHOSGHOVCLLL-NQHHJXOOSA-N PubChem CID: 53384352 IUPAC Name: (2S,3R)-3-[(2S,3S,4R,5R,6S)-3-acetamido-4-[(2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxyoxan-2-yl]oxy-2-aminobutanoic acid SMILES: CC(C(C(=O)O)N)OC1C(C(C(C(O1)COC2C(C(C(C(O2)CO)O)O)NC(=O)C)O)OC3C(C(C(C(O3)CO)O)O)NC(=O)C)NC(=O)C

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Specifications

PubChem CID	53384352
CAS	1304646-03-4
Molecular Weight (g/mol)	728.702
SMILES	CC(C(C(=O)O)N)OC1C(C(C(C(O1)COC2C(C(C(C(O2)CO)O)O)NC(=O)C)O)OC3C(C(C(C(O3)CO)O)O)NC(=O)C)NC(=O)C
IUPAC Name	(2S,3R)-3-[(2S,3S,4R,5R,6S)-3-acetamido-4-[(2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3S,4R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxyoxan-2-yl]oxy-2-aminobutanoic acid
InChI Key	HWIHOSGHOVCLLL-NQHHJXOOSA-N
Molecular Formula	C28H48N4O18

3,423

DL-Homocystine 98.0+%, TCI America™

CAS: 870-93-9 Molecular Formula: C8H16N2O4S2 Molecular Weight (g/mol): 268.346 MDL Number: MFCD00069587 InChI Key: ZTVZLYBCZNMWCF-UHFFFAOYSA-N Synonym: dl-homocystine,homocystine,4,4'-disulfanediylbis 2-aminobutanoic acid,l-homocystine,oxidized dl-homocysteine,4,4'-dithiobis 2-aminobutyric acid,d-homocystine,2-amino-4-3-amino-3-carboxypropyl disulfanyl butanoic acid,butanoic acid, 4,4'-dithiobis 2-amino,butyric acid,4'-dithiobis 2-amino PubChem CID: 10010 ChEBI: CHEBI:17485 IUPAC Name: 2-amino-4-[(3-amino-3-carboxypropyl)disulfanyl]butanoic acid SMILES: C(CSSCCC(C(=O)O)N)C(C(=O)O)N

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Specifications

PubChem CID	10010
CAS	870-93-9
Molecular Weight (g/mol)	268.346
ChEBI	CHEBI:17485
MDL Number	MFCD00069587
SMILES	C(CSSCCC(C(=O)O)N)C(C(=O)O)N
Synonym	dl-homocystine,homocystine,4,4'-disulfanediylbis 2-aminobutanoic acid,l-homocystine,oxidized dl-homocysteine,4,4'-dithiobis 2-aminobutyric acid,d-homocystine,2-amino-4-3-amino-3-carboxypropyl disulfanyl butanoic acid,butanoic acid, 4,4'-dithiobis 2-amino,butyric acid,4'-dithiobis 2-amino
IUPAC Name	2-amino-4-[(3-amino-3-carboxypropyl)disulfanyl]butanoic acid
InChI Key	ZTVZLYBCZNMWCF-UHFFFAOYSA-N
Molecular Formula	C8H16N2O4S2

3,424

Indigotetrasulfonic Acid Tetrapotassium Salt Hydrate 90.0+%, TCI America™

CAS: 28699-96-9 Molecular Formula: C16H6K4N2O14S4 Molecular Weight (g/mol): 734.86 MDL Number: MFCD00059886 InChI Key: SWRJFVUVNXWCRX-UHFFFAOYSA-J Synonym: Tetrapotassium Indigotetrasulfonate PubChem CID: 16212204 IUPAC Name: tetrapotassium 3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5',7,7'-tetrasulfonate SMILES: [K+].[K+].[K+].[K+].[O-]S(=O)(=O)C1=CC(=C2NC(C(=O)C2=C1)=C1NC2=C(C=C(C=C2C1=O)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O

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Specifications

PubChem CID	16212204
CAS	28699-96-9
Molecular Weight (g/mol)	734.86
MDL Number	MFCD00059886
SMILES	[K+].[K+].[K+].[K+].[O-]S(=O)(=O)C1=CC(=C2NC(C(=O)C2=C1)=C1NC2=C(C=C(C=C2C1=O)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O
Synonym	Tetrapotassium Indigotetrasulfonate
IUPAC Name	tetrapotassium 3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5',7,7'-tetrasulfonate
InChI Key	SWRJFVUVNXWCRX-UHFFFAOYSA-J
Molecular Formula	C16H6K4N2O14S4

3,425

Methyl (S)-(+)-2-Isocyanato-3-tert-butoxypropionate 96.0+%, TCI America™

CAS: 145080-94-0 Molecular Formula: C9H15NO4 Molecular Weight (g/mol): 201.222 MDL Number: MFCD00191536 InChI Key: MMWNVZFZWRLTCL-ZETCQYMHSA-N Synonym: (S)-(+)-2-Isocyanato-3-tert-butoxypropionic Acid Methyl Ester PubChem CID: 7019166 IUPAC Name: methyl (2S)-2-isocyanato-3-[(2-methylpropan-2-yl)oxy]propanoate SMILES: CC(C)(C)OCC(C(=O)OC)N=C=O

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Specifications

PubChem CID	7019166
CAS	145080-94-0
Molecular Weight (g/mol)	201.222
MDL Number	MFCD00191536
SMILES	CC(C)(C)OCC(C(=O)OC)N=C=O
Synonym	(S)-(+)-2-Isocyanato-3-tert-butoxypropionic Acid Methyl Ester
IUPAC Name	methyl (2S)-2-isocyanato-3-[(2-methylpropan-2-yl)oxy]propanoate
InChI Key	MMWNVZFZWRLTCL-ZETCQYMHSA-N
Molecular Formula	C9H15NO4

3,426

(R)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate 98.0+%, TCI America™

CAS: 133676-09-2 Molecular Formula: C28H38O5 Molecular Weight (g/mol): 454.607 MDL Number: MFCD21603881 InChI Key: PLGPDUBTEHIWRH-JOCHJYFZSA-N Synonym: 4-[4-(Hexyloxy)benzoyloxy]benzoic Acid (R)-2-Octyl Ester PubChem CID: 60123248 IUPAC Name: [4-[(2R)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate SMILES: CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC

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Specifications

PubChem CID	60123248
CAS	133676-09-2
Molecular Weight (g/mol)	454.607
MDL Number	MFCD21603881
SMILES	CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC
Synonym	4-[4-(Hexyloxy)benzoyloxy]benzoic Acid (R)-2-Octyl Ester
IUPAC Name	[4-[(2R)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate
InChI Key	PLGPDUBTEHIWRH-JOCHJYFZSA-N
Molecular Formula	C28H38O5

3,427

(-)-B-Chlorodiisopinocampheylborane (55-65% in Heptane, ca. 1.7mol/L), TCI America™

CAS: 85116-37-6 Molecular Formula: C20H34BCl Molecular Weight (g/mol): 320.752 MDL Number: MFCD00074807 InChI Key: PSEHHVRCDVOTID-ALTHAFQKSA-N PubChem CID: 131632371 IUPAC Name: chloro-[(1R,3R,4S,5S)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-[(1S,3R,4S,5S)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane SMILES: B(C1CC2CC(C1C)C2(C)C)(C3CC4CC(C3C)C4(C)C)Cl

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Specifications

PubChem CID	131632371
CAS	85116-37-6
Molecular Weight (g/mol)	320.752
MDL Number	MFCD00074807
SMILES	B(C1CC2CC(C1C)C2(C)C)(C3CC4CC(C3C)C4(C)C)Cl
IUPAC Name	chloro-[(1R,3R,4S,5S)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-[(1S,3R,4S,5S)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane
InChI Key	PSEHHVRCDVOTID-ALTHAFQKSA-N
Molecular Formula	C20H34BCl

3,428

Chitotriose Trihydrochloride Hydrate 93.0+%, TCI America™

CAS: 117436-78-9 Molecular Formula: C18H38Cl3N3O13 Molecular Weight (g/mol): 610.86 InChI Key: XTVOJWIUUCPOIF-ITRRTUPTSA-N Synonym: Chitosan Trimer PubChem CID: 133554226 IUPAC Name: (3S,5S,6S)-5-amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol;trihydrochloride SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)N)OC3C(OC(C(C3O)N)O)CO)CO)N)O)O)O.Cl.Cl.Cl

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Specifications

PubChem CID	133554226
CAS	117436-78-9
Molecular Weight (g/mol)	610.86
SMILES	C(C1C(C(C(C(O1)OC2C(OC(C(C2O)N)OC3C(OC(C(C3O)N)O)CO)CO)N)O)O)O.Cl.Cl.Cl
Synonym	Chitosan Trimer
IUPAC Name	(3S,5S,6S)-5-amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol;trihydrochloride
InChI Key	XTVOJWIUUCPOIF-ITRRTUPTSA-N
Molecular Formula	C18H38Cl3N3O13

3,429

Chloro[(tri-tert-butylphosphine)-2-(2-aminobiphenyl)]palladium(II) 98.0+%, TCI America™

CAS: 1375325-71-5 Molecular Formula: C24H37ClNPPd MDL Number: MFCD21608496

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Specifications

CAS	1375325-71-5
MDL Number	MFCD21608496
Molecular Formula	C24H37ClNPPd

3,430

Gentiobiose 96.0+%, TCI America™

CAS: 554-91-6 Molecular Formula: C12H22O11 MDL Number: MFCD00198056

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Specifications

CAS	554-91-6
MDL Number	MFCD00198056
Molecular Formula	C12H22O11

3,431

Geldanamycin 98.0+%, TCI America™

CAS: 30562-34-6 Molecular Formula: C29H40N2O9 Molecular Weight (g/mol): 560.644 MDL Number: MFCD00274570 InChI Key: QTQAWLPCGQOSGP-KDFVLELPSA-N Synonym: geldanamycin nsc122750 PubChem CID: 133688416 IUPAC Name: [(3S,5R,6S,7R,8Z,11R,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)OC)C)OC)OC(=O)N)C)C)O)OC

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Specifications

PubChem CID	133688416
CAS	30562-34-6
Molecular Weight (g/mol)	560.644
MDL Number	MFCD00274570
SMILES	CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)OC)C)OC)OC(=O)N)C)C)O)OC
Synonym	geldanamycin nsc122750
IUPAC Name	[(3S,5R,6S,7R,8Z,11R,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
InChI Key	QTQAWLPCGQOSGP-KDFVLELPSA-N
Molecular Formula	C29H40N2O9

3,432

Glucotropaeolin Potassium Salt 95.0+%, TCI America™

CAS: 5115-71-9 Molecular Formula: C14H18KNO9S2 Molecular Weight (g/mol): 447.514 MDL Number: MFCD00153006 InChI Key: UYCWNAZWHVREMO-GYVLLFFHSA-M PubChem CID: 70702337 IUPAC Name: potassium;[(E)-[2-phenyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylidene]amino] sulfate SMILES: C1=CC=C(C=C1)CC(=NOS(=O)(=O)[O-])SC2C(C(C(C(O2)CO)O)O)O.[K+]

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Specifications

PubChem CID	70702337
CAS	5115-71-9
Molecular Weight (g/mol)	447.514
MDL Number	MFCD00153006
SMILES	C1=CC=C(C=C1)CC(=NOS(=O)(=O)[O-])SC2C(C(C(C(O2)CO)O)O)O.[K+]
IUPAC Name	potassium;[(E)-[2-phenyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylidene]amino] sulfate
InChI Key	UYCWNAZWHVREMO-GYVLLFFHSA-M
Molecular Formula	C14H18KNO9S2

3,433

Calcium Mesoxalate Trihydrate 98.0+%, TCI America™

CAS: 21085-60-9 Molecular Formula: C6H6CaO12 Molecular Weight (g/mol): 310.18 MDL Number: MFCD00150291 InChI Key: QHOHAGRGHNXSFU-UHFFFAOYSA-L Synonym: Mesoxalic Acid Calcium Salt, Calcium Ketomalonate PubChem CID: 131674760 IUPAC Name: calcium;2-oxopropanedioate;2-oxopropanedioic acid;dihydrate SMILES: C(=O)(C(=O)O)C(=O)O.C(=O)(C(=O)[O-])C(=O)[O-].O.O.[Ca+2]

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Specifications

PubChem CID	131674760
CAS	21085-60-9
Molecular Weight (g/mol)	310.18
MDL Number	MFCD00150291
SMILES	C(=O)(C(=O)O)C(=O)O.C(=O)(C(=O)[O-])C(=O)[O-].O.O.[Ca+2]
Synonym	Mesoxalic Acid Calcium Salt, Calcium Ketomalonate
IUPAC Name	calcium;2-oxopropanedioate;2-oxopropanedioic acid;dihydrate
InChI Key	QHOHAGRGHNXSFU-UHFFFAOYSA-L
Molecular Formula	C6H6CaO12

3,434

Oleyl Phosphate (Mono- and Di- Ester mixture), TCI America™

CAS: 37310-83-1 MDL Number: MFCD00135103 Synonym: Phosphoric Acid Oleyl Ester

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Specifications

CAS	37310-83-1
MDL Number	MFCD00135103
Synonym	Phosphoric Acid Oleyl Ester

3,435

2-(9-Oxoxanthen-2-yl)propionic Acid 98.0+%, TCI America™

CAS: 30087-33-3 Molecular Formula: C16H12O4 Molecular Weight (g/mol): 268.268 InChI Key: JUCCZCZDAPBGIV-UHFFFAOYSA-N PubChem CID: 161655 IUPAC Name: 2-(9-oxoxanthen-2-yl)propanoic acid SMILES: CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)O

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Specifications

PubChem CID	161655
CAS	30087-33-3
Molecular Weight (g/mol)	268.268
SMILES	CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)O
IUPAC Name	2-(9-oxoxanthen-2-yl)propanoic acid
InChI Key	JUCCZCZDAPBGIV-UHFFFAOYSA-N
Molecular Formula	C16H12O4

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