Unclassified Organic Compounds

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

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2,581 – 2,595 of 162,941 results

2,581

Tolylene Diisocyanate (2,4- ca. 80%, 2,6- ca. 20%) 98.0+%, TCI America™

CAS: 26471-62-5 Molecular Formula: C9H6N2O2 MDL Number: MFCD01778251 Synonym: Toluene Diisocyanate

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Specifications

CAS	26471-62-5
MDL Number	MFCD01778251
Synonym	Toluene Diisocyanate
Molecular Formula	C9H6N2O2

2,582

Tris(2,4-pentanedionato)cobalt(III) 98.0+%, TCI America™

CAS: 21679-46-9 Molecular Formula: C15H21CoO6 Molecular Weight (g/mol): 356.26 MDL Number: MFCD00013488 InChI Key: VACIXPOMJJIDBM-UHFFFAOYSA-N Synonym: Acetylacetone Cobalt(III) Salt, Cobalt(III) Acetylacetonate IUPAC Name: 2,4,8,10,13,15-hexamethyl-1λ³,5λ³,7λ³,11λ³,12λ³,16λ³-hexaoxa-6-cobaltaspiro[5.5⁶.5⁶]hexadeca-1,4,7,10,12,15-hexaene-6,6,6-tris(ylium)-3,9,14-triide SMILES: CC1=[O][Co+3]234([O]=C(C)[CH-]1)[O]=C(C)[CH-]C(C)=[O]2.CC([CH-]C(C)=[O]3)=[O]4

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Specifications

CAS	21679-46-9
Molecular Weight (g/mol)	356.26
MDL Number	MFCD00013488
SMILES	CC1=[O][Co+3]234([O]=C(C)[CH-]1)[O]=C(C)[CH-]C(C)=[O]2.CC([CH-]C(C)=[O]3)=[O]4
Synonym	Acetylacetone Cobalt(III) Salt, Cobalt(III) Acetylacetonate
IUPAC Name	2,4,8,10,13,15-hexamethyl-1λ³,5λ³,7λ³,11λ³,12λ³,16λ³-hexaoxa-6-cobaltaspiro[5.5⁶.5⁶]hexadeca-1,4,7,10,12,15-hexaene-6,6,6-tris(ylium)-3,9,14-triide
InChI Key	VACIXPOMJJIDBM-UHFFFAOYSA-N
Molecular Formula	C15H21CoO6

2,583

2-(1-Hydroxy-3-methylbutylidene)-5,5-dimethyl-1,3-cyclohexanedione 98.0+%, TCI America™

CAS: 172611-72-2 Molecular Formula: C13H20O3 Molecular Weight (g/mol): 224.3 MDL Number: MFCD01862890 InChI Key: HNPWTDUZIXAJSA-UHFFFAOYSA-N Synonym: 2-(1-Hydroxy-3-methylbutylidene)dimedone PubChem CID: 22728397 IUPAC Name: 5,5-dimethyl-2-(3-methylbutanoyl)cyclohexane-1,3-dione SMILES: CC(C)CC(=O)C1C(=O)CC(CC1=O)(C)C

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Specifications

PubChem CID	22728397
CAS	172611-72-2
Molecular Weight (g/mol)	224.3
MDL Number	MFCD01862890
SMILES	CC(C)CC(=O)C1C(=O)CC(CC1=O)(C)C
Synonym	2-(1-Hydroxy-3-methylbutylidene)dimedone
IUPAC Name	5,5-dimethyl-2-(3-methylbutanoyl)cyclohexane-1,3-dione
InChI Key	HNPWTDUZIXAJSA-UHFFFAOYSA-N
Molecular Formula	C13H20O3

2,584

4-Benzoyl-3-methyl-1-phenyl-5-pyrazolone 98.0+%, TCI America™

CAS: 4551-69-3 Molecular Formula: C17H14N2O2 MDL Number: MFCD00003136

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Specifications

CAS	4551-69-3
MDL Number	MFCD00003136
Molecular Formula	C17H14N2O2

2,585

Tripropylene Glycol Monomethyl Ether (mixture of isomer) 93.0+%, TCI America™

CAS: 25498-49-1 Molecular Formula: C10H22O4 MDL Number: MFCD00059142

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Specifications

CAS	25498-49-1
MDL Number	MFCD00059142
Molecular Formula	C10H22O4

2,586

2-Cyclopenten-1-one 96.0+%, TCI America™

CAS: 930-30-3 Molecular Formula: C5H6O Molecular Weight (g/mol): 82.10 MDL Number: MFCD00001401 InChI Key: BZKFMUIJRXWWQK-UHFFFAOYSA-N Synonym: 2-cyclopenten-1-one,2-cyclopentenone,cyclopentenone,cyclopent-2-enone,cyclopenten-3-one,2-cyclopentene-1-one,cyclopent-2-ene-1-one,unii-q0u2igf9ck,3-cyclopenten-2-one,q0u2igf9ck PubChem CID: 13588 IUPAC Name: cyclopent-2-en-1-one SMILES: O=C1CCC=C1

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Specifications

PubChem CID	13588
CAS	930-30-3
Molecular Weight (g/mol)	82.10
MDL Number	MFCD00001401
SMILES	O=C1CCC=C1
Synonym	2-cyclopenten-1-one,2-cyclopentenone,cyclopentenone,cyclopent-2-enone,cyclopenten-3-one,2-cyclopentene-1-one,cyclopent-2-ene-1-one,unii-q0u2igf9ck,3-cyclopenten-2-one,q0u2igf9ck
IUPAC Name	cyclopent-2-en-1-one
InChI Key	BZKFMUIJRXWWQK-UHFFFAOYSA-N
Molecular Formula	C5H6O

2,587

Trisodium N-(1-Carboxylatoethyl)iminodiacetate Hydrate 95.0+%, TCI America™

CAS: 164462-16-2 Molecular Formula: C7H11NNa3O6 Molecular Weight (g/mol): 274.135 InChI Key: SQKOOOSPGWXVRN-UHFFFAOYSA-N Synonym: n,n-bis carboxylatomethyl alanine trisodium salt PubChem CID: 131849341 IUPAC Name: 2-[bis(carboxymethyl)amino]propanoic acid;sodium SMILES: CC(C(=O)O)N(CC(=O)O)CC(=O)O.[Na].[Na].[Na]

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Specifications

PubChem CID	131849341
CAS	164462-16-2
Molecular Weight (g/mol)	274.135
SMILES	CC(C(=O)O)N(CC(=O)O)CC(=O)O.[Na].[Na].[Na]
Synonym	n,n-bis carboxylatomethyl alanine trisodium salt
IUPAC Name	2-[bis(carboxymethyl)amino]propanoic acid;sodium
InChI Key	SQKOOOSPGWXVRN-UHFFFAOYSA-N
Molecular Formula	C7H11NNa3O6

2,588

1,5-Diphenyl-3-(2-thienyl)formazan 96.0+%, TCI America™

CAS: 135984-01-9 Molecular Formula: C17H14N4S Molecular Weight (g/mol): 306.387 MDL Number: MFCD00059744 InChI Key: YYNVZGCGVPELJN-GSPFKFNASA-N Synonym: STC Formazan PubChem CID: 66485618 IUPAC Name: N'-anilino-N-phenyliminothiophene-2-carboximidamide SMILES: C1=CC=C(C=C1)NN=C(C2=CC=CS2)N=NC3=CC=CC=C3

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Specifications

PubChem CID	66485618
CAS	135984-01-9
Molecular Weight (g/mol)	306.387
MDL Number	MFCD00059744
SMILES	C1=CC=C(C=C1)NN=C(C2=CC=CS2)N=NC3=CC=CC=C3
Synonym	STC Formazan
IUPAC Name	N'-anilino-N-phenyliminothiophene-2-carboximidamide
InChI Key	YYNVZGCGVPELJN-GSPFKFNASA-N
Molecular Formula	C17H14N4S

2,589

1,5-Diethynyl-2,4-dimethylbenzene 98.0+%, TCI America™

CAS: 1379822-09-9 Molecular Formula: C12H10 Molecular Weight (g/mol): 154.212 InChI Key: HPFZIHSKAUBEON-UHFFFAOYSA-N PubChem CID: 102363018 IUPAC Name: 1,5-diethynyl-2,4-dimethylbenzene SMILES: CC1=CC(=C(C=C1C#C)C#C)C

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Specifications

PubChem CID	102363018
CAS	1379822-09-9
Molecular Weight (g/mol)	154.212
SMILES	CC1=CC(=C(C=C1C#C)C#C)C
IUPAC Name	1,5-diethynyl-2,4-dimethylbenzene
InChI Key	HPFZIHSKAUBEON-UHFFFAOYSA-N
Molecular Formula	C12H10

2,590

Ethyl(dimethyl)(2-phenylethyl)ammonium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™

CAS: 1804970-28-2 Molecular Formula: C14H20F6N2O4S2 Molecular Weight (g/mol): 458.434 InChI Key: XVNMSYLRWLNKMT-UHFFFAOYSA-N Synonym: Ethyl(dimethyl)phenethylammonium Bis(trifluoromethanesulfonyl)imide PubChem CID: 121234255 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;ethyl-dimethyl-(2-phenylethyl)azanium SMILES: CC[N+](C)(C)CCC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

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Specifications

PubChem CID	121234255
CAS	1804970-28-2
Molecular Weight (g/mol)	458.434
SMILES	CC[N+](C)(C)CCC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
Synonym	Ethyl(dimethyl)phenethylammonium Bis(trifluoromethanesulfonyl)imide
IUPAC Name	bis(trifluoromethylsulfonyl)azanide;ethyl-dimethyl-(2-phenylethyl)azanium
InChI Key	XVNMSYLRWLNKMT-UHFFFAOYSA-N
Molecular Formula	C14H20F6N2O4S2

2,591

O-tert-Butyl-L-serine 97.0+%, TCI America™

CAS: 18822-58-7 Molecular Formula: C7H15NO3 Molecular Weight (g/mol): 161.201 MDL Number: MFCD00066088 InChI Key: DDCPKNYKNWXULB-YFKPBYRVSA-N Synonym: h-ser tbu-oh,o-tert-butyl-l-serine,o-t-butyl-l-serine,s-2-amino-3-tert-butoxy propanoic acid,l-serine, o-1,1-dimethylethyl,2s-2-amino-3-tert-butoxy propanoic acid,2s-2-amino-3-2-methylpropan-2-yl oxy propanoic acid,ser tbu-oh,h-ser but-oh PubChem CID: 7004940 IUPAC Name: (2S)-2-amino-3-[(2-methylpropan-2-yl)oxy]propanoic acid SMILES: CC(C)(C)OCC(C(=O)O)N

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Specifications

PubChem CID	7004940
CAS	18822-58-7
Molecular Weight (g/mol)	161.201
MDL Number	MFCD00066088
SMILES	CC(C)(C)OCC(C(=O)O)N
Synonym	h-ser tbu-oh,o-tert-butyl-l-serine,o-t-butyl-l-serine,s-2-amino-3-tert-butoxy propanoic acid,l-serine, o-1,1-dimethylethyl,2s-2-amino-3-tert-butoxy propanoic acid,2s-2-amino-3-2-methylpropan-2-yl oxy propanoic acid,ser tbu-oh,h-ser but-oh
IUPAC Name	(2S)-2-amino-3-[(2-methylpropan-2-yl)oxy]propanoic acid
InChI Key	DDCPKNYKNWXULB-YFKPBYRVSA-N
Molecular Formula	C7H15NO3

2,592

Pyridine-3-carboximidamide Monohydrochloride 98.0+%, TCI America™

CAS: 7356-60-7 Molecular Formula: C6H8ClN3 Molecular Weight (g/mol): 157.601 MDL Number: MFCD00054326 InChI Key: MKJPBOVLAZADQJ-UHFFFAOYSA-N Synonym: nicotinimidamide hydrochloride,3-amidinopyridine hydrochloride,pyridine-3-carboximidamide hydrochloride,nicotinamidine hydrochloride,3-pyridinecarboximidamide, monohydrochloride,nicotinamidine, hydrochloride,pyridine-3-carbonamidine hydrochloride,pyridine-3-carboxamidine hydrochloride,3-pyridinecarboxamidine hydrochloride,pyridine-3-carboximidamide hcl PubChem CID: 202042 IUPAC Name: pyridine-3-carboximidamide;hydrochloride SMILES: C1=CC(=CN=C1)C(=N)N.Cl

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Specifications

PubChem CID	202042
CAS	7356-60-7
Molecular Weight (g/mol)	157.601
MDL Number	MFCD00054326
SMILES	C1=CC(=CN=C1)C(=N)N.Cl
Synonym	nicotinimidamide hydrochloride,3-amidinopyridine hydrochloride,pyridine-3-carboximidamide hydrochloride,nicotinamidine hydrochloride,3-pyridinecarboximidamide, monohydrochloride,nicotinamidine, hydrochloride,pyridine-3-carbonamidine hydrochloride,pyridine-3-carboxamidine hydrochloride,3-pyridinecarboxamidine hydrochloride,pyridine-3-carboximidamide hcl
IUPAC Name	pyridine-3-carboximidamide;hydrochloride
InChI Key	MKJPBOVLAZADQJ-UHFFFAOYSA-N
Molecular Formula	C6H8ClN3

2,593

Pneumocandin B0 96.0+%, TCI America™

CAS: 135575-42-7 Molecular Formula: C50H80N8O17 Molecular Weight (g/mol): 1065.229 MDL Number: MFCD28168025 InChI Key: DQXPFAADCTZLNL-NRCXNPJQSA-N PubChem CID: 133562761 SMILES: CCC(C)CC(C)CCCCCCCCC(=O)NC1CC(C(NC(=O)C2C(CCN2C(=O)C(NC(=O)C(NC(=O)C3CC(CN3C(=O)C(NC1=O)C(C)O)O)C(C(C4=CC=C(C=C4)O)O)O)C(CC(=O)N)O)O)O)O

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Specifications

PubChem CID	133562761
CAS	135575-42-7
Molecular Weight (g/mol)	1065.229
MDL Number	MFCD28168025
SMILES	CCC(C)CC(C)CCCCCCCCC(=O)NC1CC(C(NC(=O)C2C(CCN2C(=O)C(NC(=O)C(NC(=O)C3CC(CN3C(=O)C(NC1=O)C(C)O)O)C(C(C4=CC=C(C=C4)O)O)O)C(CC(=O)N)O)O)O)O
InChI Key	DQXPFAADCTZLNL-NRCXNPJQSA-N
Molecular Formula	C50H80N8O17

2,594

4-Hydroxy-D-(-)-2-phenylglycine 99.0+%, TCI America™

CAS: 22818-40-2 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00004262 InChI Key: LJCWONGJFPCTTL-SSDOTTSWSA-N Synonym: d-4-hydroxyphenylglycine,4-hydroxy-d-phenylglycine,d--4-hydroxyphenylglycine,h-d-phg 4-oh-oh,d-n-4-hydroxyphenyl glycine,2r-2-amino-2-4-hydroxyphenyl acetic acid,r-2-amino-2-4-hydroxyphenyl acetic acid,r-alpha-amino-4-hydroxybenzeneacetic acid,d---4-hydroxyphenylglycine,unii-pcm9oix717 PubChem CID: 89853 ChEBI: CHEBI:15695 IUPAC Name: (2R)-2-amino-2-(4-hydroxyphenyl)acetic acid SMILES: C1=CC(=CC=C1C(C(=O)O)N)O

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Specifications

PubChem CID	89853
CAS	22818-40-2
Molecular Weight (g/mol)	167.164
ChEBI	CHEBI:15695
MDL Number	MFCD00004262
SMILES	C1=CC(=CC=C1C(C(=O)O)N)O
Synonym	d-4-hydroxyphenylglycine,4-hydroxy-d-phenylglycine,d--4-hydroxyphenylglycine,h-d-phg 4-oh-oh,d-n-4-hydroxyphenyl glycine,2r-2-amino-2-4-hydroxyphenyl acetic acid,r-2-amino-2-4-hydroxyphenyl acetic acid,r-alpha-amino-4-hydroxybenzeneacetic acid,d---4-hydroxyphenylglycine,unii-pcm9oix717
IUPAC Name	(2R)-2-amino-2-(4-hydroxyphenyl)acetic acid
InChI Key	LJCWONGJFPCTTL-SSDOTTSWSA-N
Molecular Formula	C8H9NO3

2,595

Phenyl 4-Hydroxybenzoate 99.0+%, TCI America™

CAS: 17696-62-7 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00016467 InChI Key: GJLNWLVPAHNBQN-UHFFFAOYSA-N Synonym: 4-Hydroxybenzoic Acid Phenyl Ester, Phenylparaben PubChem CID: 87250 IUPAC Name: phenyl 4-hydroxybenzoate SMILES: C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)O

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Specifications

PubChem CID	87250
CAS	17696-62-7
Molecular Weight (g/mol)	214.22
MDL Number	MFCD00016467
SMILES	C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)O
Synonym	4-Hydroxybenzoic Acid Phenyl Ester, Phenylparaben
IUPAC Name	phenyl 4-hydroxybenzoate
InChI Key	GJLNWLVPAHNBQN-UHFFFAOYSA-N
Molecular Formula	C13H10O3

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