Unclassified Organic Compounds

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

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421 – 435 of 162,845 results

421

Witch Hazel, USP, Spectrum™ Chemical

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422

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1-Methyl-2-Pyrrolidone, 99.7%, MilliporeSigma™

CAS: 872-50-4 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 InChI Key: SECXISVLQFMRJM-UHFFFAOYSA-N IUPAC Name: 1-methylpyrrolidin-2-one SMILES: CN1CCCC1=O

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CAS	872-50-4
Molecular Weight (g/mol)	99.13
SMILES	CN1CCCC1=O
IUPAC Name	1-methylpyrrolidin-2-one
InChI Key	SECXISVLQFMRJM-UHFFFAOYSA-N
Molecular Formula	C5H9NO

423

N-Benzyloxycarbonyl-D-glutamic acid 1-benzyl ester, 97%

CAS: 65706-99-2 Molecular Formula: C20H21NO6 Molecular Weight (g/mol): 371.389 MDL Number: MFCD00069647 InChI Key: VWHKODOUMSMUAF-QGZVFWFLSA-N Synonym: z-d-glu-obzl,cbz-d-glu-obzl,n-cbz-d-glutamic acid alpha-benzyl ester,r-5-benzyloxy-4-benzyloxy carbonyl amino-5-oxopentanoic acid,1-benzyl n-carbobenzoxy-d-glutamate,4r-5-benzyloxy-4-benzyloxy carbonyl amino-5-oxopentanoic acid,z-d-glu-obn,cbz-d-glu-och2ph,pubchem14966,cbz-d-glu oh-obzl PubChem CID: 7018162 IUPAC Name: (4R)-5-oxo-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoic acid SMILES: C1=CC=C(C=C1)COC(=O)C(CCC(=O)O)NC(=O)OCC2=CC=CC=C2

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PubChem CID	7018162
CAS	65706-99-2
Molecular Weight (g/mol)	371.389
MDL Number	MFCD00069647
SMILES	C1=CC=C(C=C1)COC(=O)C(CCC(=O)O)NC(=O)OCC2=CC=CC=C2
Synonym	z-d-glu-obzl,cbz-d-glu-obzl,n-cbz-d-glutamic acid alpha-benzyl ester,r-5-benzyloxy-4-benzyloxy carbonyl amino-5-oxopentanoic acid,1-benzyl n-carbobenzoxy-d-glutamate,4r-5-benzyloxy-4-benzyloxy carbonyl amino-5-oxopentanoic acid,z-d-glu-obn,cbz-d-glu-och2ph,pubchem14966,cbz-d-glu oh-obzl
IUPAC Name	(4R)-5-oxo-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoic acid
InChI Key	VWHKODOUMSMUAF-QGZVFWFLSA-N
Molecular Formula	C20H21NO6

424

Choline Dihydrogen Citrate, 98%, Spectrum™ Chemical

CAS: 77-91-8 Molecular Formula: C11H21NO8 Molecular Weight (g/mol): 295.29 InChI Key: WRPUOFKIGGWQIJ-UHFFFAOYSA-M IUPAC Name: (2-hydroxyethyl)trimethylazanium 3-carboxy-2-(carboxymethyl)-2-hydroxypropanoate SMILES: C[N+](C)(C)CCO.OC(=O)CC(O)(CC(O)=O)C([O-])=O

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CAS	77-91-8
Molecular Weight (g/mol)	295.29
SMILES	C[N+](C)(C)CCO.OC(=O)CC(O)(CC(O)=O)C([O-])=O
IUPAC Name	(2-hydroxyethyl)trimethylazanium 3-carboxy-2-(carboxymethyl)-2-hydroxypropanoate
InChI Key	WRPUOFKIGGWQIJ-UHFFFAOYSA-M
Molecular Formula	C11H21NO8

425

Methyl 2-isothiocyanatoacetate, 98%

CAS: 21055-37-8 Molecular Formula: C4H5NO2S Molecular Weight (g/mol): 131.149 MDL Number: MFCD00041119 InChI Key: GOWGDPFDGIPFIK-UHFFFAOYSA-N Synonym: methyl isothiocyanatoacetate,acetic acid, isothiocyanato-, methyl ester,acmc-20akih,propargyl benzene sulphonate,methyl-2-isothiocyanatoacetate,methyl isothiocyanatoacetate #,methyl 2-isothiocyanatoethanoate,methyl n-thioxomethylene glycinate,isothiocyanatoacetic acid methyl ester,2-isothiocyanatoacetic acid methyl ester PubChem CID: 140795 IUPAC Name: methyl 2-isothiocyanatoacetate SMILES: COC(=O)CN=C=S

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PubChem CID	140795
CAS	21055-37-8
Molecular Weight (g/mol)	131.149
MDL Number	MFCD00041119
SMILES	COC(=O)CN=C=S
Synonym	methyl isothiocyanatoacetate,acetic acid, isothiocyanato-, methyl ester,acmc-20akih,propargyl benzene sulphonate,methyl-2-isothiocyanatoacetate,methyl isothiocyanatoacetate #,methyl 2-isothiocyanatoethanoate,methyl n-thioxomethylene glycinate,isothiocyanatoacetic acid methyl ester,2-isothiocyanatoacetic acid methyl ester
IUPAC Name	methyl 2-isothiocyanatoacetate
InChI Key	GOWGDPFDGIPFIK-UHFFFAOYSA-N
Molecular Formula	C4H5NO2S

426

Diethylthiocarbamoyl chloride, Thermo Scientific Chemicals

CAS: 88-11-9 Molecular Formula: C5H10ClNS Molecular Weight (g/mol): 151.65 MDL Number: MFCD00022106 InChI Key: HUUSTUALCPTCGJ-UHFFFAOYSA-N IUPAC Name: (chloromethanethioyl)diethylamine SMILES: CCN(CC)C(Cl)=S

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Specifications

CAS	88-11-9
Molecular Weight (g/mol)	151.65
MDL Number	MFCD00022106
SMILES	CCN(CC)C(Cl)=S
IUPAC Name	(chloromethanethioyl)diethylamine
InChI Key	HUUSTUALCPTCGJ-UHFFFAOYSA-N
Molecular Formula	C5H10ClNS

427

BIGCHAP, MP Biomedicals™

CAS: 86303-22-2 Molecular Formula: C42H75N3O16 Molecular Weight (g/mol): 878.067 InChI Key: ZWEVPYNPHSPIFU-MNSMTYRASA-N Synonym: n,n'-bis 3-d-glucon-amidopropyl cholamide,n n-bis 3-d-gluconamido-propyl,bigchap n,n-bis 3-d-gluconamidopropyl-cholamide,3a,5b,7a,12a-n,n-bis 3-d-gluconoylamino propyl-3,7,12-trihydroxycholan-24-amide PubChem CID: 122130704 IUPAC Name: (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxy-N-[3-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoyl]amino]propyl-[(4R)-4-[(3R,5S,7R,12S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan SMILES: CC(CCC(=O)N(CCCNC(=O)C(C(C(C(CO)O)O)O)O)CCCNC(=O)C(C(C(C(CO)O)O)O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C

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Specifications

PubChem CID	122130704
CAS	86303-22-2
Molecular Weight (g/mol)	878.067
SMILES	CC(CCC(=O)N(CCCNC(=O)C(C(C(C(CO)O)O)O)O)CCCNC(=O)C(C(C(C(CO)O)O)O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Synonym	n,n'-bis 3-d-glucon-amidopropyl cholamide,n n-bis 3-d-gluconamido-propyl,bigchap n,n-bis 3-d-gluconamidopropyl-cholamide,3a,5b,7a,12a-n,n-bis 3-d-gluconoylamino propyl-3,7,12-trihydroxycholan-24-amide
IUPAC Name	(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxy-N-[3-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoyl]amino]propyl-[(4R)-4-[(3R,5S,7R,12S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan
InChI Key	ZWEVPYNPHSPIFU-MNSMTYRASA-N
Molecular Formula	C42H75N3O16

428

2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl bromide, 98.5%

CAS: 572-09-8 Molecular Formula: C14H19BrO9 Molecular Weight (g/mol): 411.20 MDL Number: MFCD00063254 InChI Key: CYAYKKUWALRRPA-HAGGZJDPNA-N Synonym: 2,3,4,6-tetra-o-acetyl-alpha-d-glucopyranosyl bromide,acetobromglucose,acetobromoglucose,acetobromo-alpha-d-glucose,a-acetobromglucose,acetobromo glucose,2,3,4,6-tetra-o-acetyl-,a-d-glucopyranosyl bromide,2r,3r,4s,5r,6r-3,4,5-tris acetyloxy-6-bromooxan-2-yl methyl acetate,2r,3r,4s,5r,6r-3,4,5-triacetyloxy-6-bromooxan-2-yl methyl acetate,2,3,4,6-tetra-o-acetyl-alpha-d-glucopyranosyl bromide, stab. with calcium carbonate PubChem CID: 101776 IUPAC Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetate SMILES: CC(=O)OC[C@H]1O[C@H](Br)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

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Specifications

PubChem CID	101776
CAS	572-09-8
Molecular Weight (g/mol)	411.20
MDL Number	MFCD00063254
SMILES	CC(=O)OC[C@H]1O[C@H](Br)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
Synonym	2,3,4,6-tetra-o-acetyl-alpha-d-glucopyranosyl bromide,acetobromglucose,acetobromoglucose,acetobromo-alpha-d-glucose,a-acetobromglucose,acetobromo glucose,2,3,4,6-tetra-o-acetyl-,a-d-glucopyranosyl bromide,2r,3r,4s,5r,6r-3,4,5-tris acetyloxy-6-bromooxan-2-yl methyl acetate,2r,3r,4s,5r,6r-3,4,5-triacetyloxy-6-bromooxan-2-yl methyl acetate,2,3,4,6-tetra-o-acetyl-alpha-d-glucopyranosyl bromide, stab. with calcium carbonate
IUPAC Name	[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetate
InChI Key	CYAYKKUWALRRPA-HAGGZJDPNA-N
Molecular Formula	C14H19BrO9

429

1,2,3-Tri-O-acetyl-5-deoxy-beta-D-ribofuranose, 98%

CAS: 62211-93-2 Molecular Formula: C11H16O7 Molecular Weight (g/mol): 260.24 MDL Number: MFCD08458459,MFCD08458459 InChI Key: NXEJETQVUQAKTO-UHFFFAOYNA-N Synonym: 1,2,3-triacety1-5-deoxy-beta-d-ribofuranose PubChem CID: 70847275 IUPAC Name: [(2R,5S)-4,5-diacetyloxy-2-methyloxolan-3-yl] acetate SMILES: CC1OC(OC(C)=O)C(OC(C)=O)C1OC(C)=O

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Specifications

PubChem CID	70847275
CAS	62211-93-2
Molecular Weight (g/mol)	260.24
MDL Number	MFCD08458459,MFCD08458459
SMILES	CC1OC(OC(C)=O)C(OC(C)=O)C1OC(C)=O
Synonym	1,2,3-triacety1-5-deoxy-beta-d-ribofuranose
IUPAC Name	[(2R,5S)-4,5-diacetyloxy-2-methyloxolan-3-yl] acetate
InChI Key	NXEJETQVUQAKTO-UHFFFAOYNA-N
Molecular Formula	C11H16O7

430

Thermo Scientific Chemicals D(-)-alpha-Phenylglycine, 98%

CAS: 875-74-1 Molecular Formula: C₈H₉NO₂ Molecular Weight (g/mol): 151.16 MDL Number: MFCD00008061 InChI Key: ZGUNAGUHMKGQNY-SSDOTTSWSA-N Synonym: d-phenylglycine,d---alpha-phenylglycine,h-d-phg-oh,d-2-phenylglycine,r-2-amino-2-phenylacetic acid,r-phenylglycine,r---2-phenylglycine,d-alpha-phenylglycine,2r-2-amino-2-phenylacetic acid,2r-amino phenyl acetic acid PubChem CID: 70134 ChEBI: CHEBI:44962 IUPAC Name: (2R)-2-amino-2-phenylacetic acid SMILES: C1=CC=C(C=C1)C(C(=O)O)N

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Specifications

PubChem CID	70134
CAS	875-74-1
Molecular Weight (g/mol)	151.16
ChEBI	CHEBI:44962
MDL Number	MFCD00008061
SMILES	C1=CC=C(C=C1)C(C(=O)O)N
Synonym	d-phenylglycine,d---alpha-phenylglycine,h-d-phg-oh,d-2-phenylglycine,r-2-amino-2-phenylacetic acid,r-phenylglycine,r---2-phenylglycine,d-alpha-phenylglycine,2r-2-amino-2-phenylacetic acid,2r-amino phenyl acetic acid
IUPAC Name	(2R)-2-amino-2-phenylacetic acid
InChI Key	ZGUNAGUHMKGQNY-SSDOTTSWSA-N
Molecular Formula	C₈H₉NO₂

431

Ethyl 2-isothiocyanatopropionate, 97%

CAS: 39574-16-8 Molecular Formula: C6H9NO2S Molecular Weight (g/mol): 159.20 MDL Number: MFCD00070636 InChI Key: ALJGYASQFZQQJX-UHFFFAOYNA-N Synonym: ethyl 2-isothiocyanatopropionate,ethyl n-thioxomethylene alaninate,propanoic acid, 2-isothiocyanato-, ethyl ester,acmc-20al0z,acmc-20lue7,propanoic acid, 2-isothiocyanato-, ethyl ester, s,ethyl l-2-isothiocyanatopropanoate,alanine, n-carbonothioyl-, ethyl ester PubChem CID: 142361 IUPAC Name: ethyl 2-isothiocyanatopropanoate SMILES: CCOC(=O)C(C)N=C=S

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Specifications

PubChem CID	142361
CAS	39574-16-8
Molecular Weight (g/mol)	159.20
MDL Number	MFCD00070636
SMILES	CCOC(=O)C(C)N=C=S
Synonym	ethyl 2-isothiocyanatopropionate,ethyl n-thioxomethylene alaninate,propanoic acid, 2-isothiocyanato-, ethyl ester,acmc-20al0z,acmc-20lue7,propanoic acid, 2-isothiocyanato-, ethyl ester, s,ethyl l-2-isothiocyanatopropanoate,alanine, n-carbonothioyl-, ethyl ester
IUPAC Name	ethyl 2-isothiocyanatopropanoate
InChI Key	ALJGYASQFZQQJX-UHFFFAOYNA-N
Molecular Formula	C6H9NO2S

432

4-Fluoro-DL-α-phenylglycine, 98+%, Thermo Scientific™

CAS: 7292-73-1 Molecular Formula: C8H8FNO2 Molecular Weight (g/mol): 169.16 MDL Number: MFCD00066444,MFCD00042727 InChI Key: JKFYKCYQEWQPTM-UHFFFAOYNA-N Synonym: 2-amino-2-4-fluorophenyl acetic acid,4-fluoro-dl-phenylglycine,4-fluoro-dl-alpha-phenylglycine,dl-4-fluorophenylglycine,amino 4-fluorophenyl acetic acid,4-fluorophenylglycine,dl-4-fluorophenyl glycine,amino-4-fluoro-phenyl-acetic acid,dl-alpha-4-fluorophenyl-glycine,benzeneacetic acid, alpha-amino-4-fluoro PubChem CID: 98313 IUPAC Name: 2-amino-2-(4-fluorophenyl)acetic acid SMILES: NC(C(O)=O)C1=CC=C(F)C=C1

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Specifications

PubChem CID	98313
CAS	7292-73-1
Molecular Weight (g/mol)	169.16
MDL Number	MFCD00066444,MFCD00042727
SMILES	NC(C(O)=O)C1=CC=C(F)C=C1
Synonym	2-amino-2-4-fluorophenyl acetic acid,4-fluoro-dl-phenylglycine,4-fluoro-dl-alpha-phenylglycine,dl-4-fluorophenylglycine,amino 4-fluorophenyl acetic acid,4-fluorophenylglycine,dl-4-fluorophenyl glycine,amino-4-fluoro-phenyl-acetic acid,dl-alpha-4-fluorophenyl-glycine,benzeneacetic acid, alpha-amino-4-fluoro
IUPAC Name	2-amino-2-(4-fluorophenyl)acetic acid
InChI Key	JKFYKCYQEWQPTM-UHFFFAOYNA-N
Molecular Formula	C8H8FNO2

433

Calcium thioglycolate trihydrate, 99%

CAS: 65208-41-5 Molecular Formula: C2H10CaO5S Molecular Weight (g/mol): 186.24 MDL Number: MFCD00150707 InChI Key: GDECCIJZCWLFSB-UHFFFAOYSA-N Synonym: calciumthioglycolatetrihydrate PubChem CID: 131881455 SMILES: O.O.O.[Ca].OC(=O)CS

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Specifications

PubChem CID	131881455
CAS	65208-41-5
Molecular Weight (g/mol)	186.24
MDL Number	MFCD00150707
SMILES	O.O.O.[Ca].OC(=O)CS
Synonym	calciumthioglycolatetrihydrate
InChI Key	GDECCIJZCWLFSB-UHFFFAOYSA-N
Molecular Formula	C2H10CaO5S

434

Thermo Scientific Chemicals N-Acetyl-L-leucine, 99%

CAS: 1188-21-2 Molecular Formula: C8H15NO3 Molecular Weight (g/mol): 173.21 MDL Number: MFCD00065131 InChI Key: WXNXCEHXYPACJF-JLDDOWRYNA-N Synonym: n-acetyl-l-leucine,acetyl-l-leucine,ac-leu-oh,n-acetylleucine,s-2-acetamido-4-methylpentanoic acid,n-acetyl-leu,2s-2-acetamido-4-methylpentanoic acid,n-acetyl-leucine,leucine, n-acetyl-, l,n-acetyl-l-leucin PubChem CID: 70912 ChEBI: CHEBI:17786 IUPAC Name: (2S)-2-acetamido-4-methylpentanoic acid SMILES: CC(C)C[C@H](NC(C)=O)C(O)=O

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Specifications

PubChem CID	70912
CAS	1188-21-2
Molecular Weight (g/mol)	173.21
ChEBI	CHEBI:17786
MDL Number	MFCD00065131
SMILES	CC(C)C[C@H](NC(C)=O)C(O)=O
Synonym	n-acetyl-l-leucine,acetyl-l-leucine,ac-leu-oh,n-acetylleucine,s-2-acetamido-4-methylpentanoic acid,n-acetyl-leu,2s-2-acetamido-4-methylpentanoic acid,n-acetyl-leucine,leucine, n-acetyl-, l,n-acetyl-l-leucin
IUPAC Name	(2S)-2-acetamido-4-methylpentanoic acid
InChI Key	WXNXCEHXYPACJF-JLDDOWRYNA-N
Molecular Formula	C8H15NO3

435

3-Formylsalicylic acid hydrate, 97%

CAS: 1266615-78-4 Molecular Formula: C8H6O4 Molecular Weight (g/mol): 166.13 MDL Number: MFCD03804454 InChI Key: YOEUNKPREOJHBW-UHFFFAOYSA-N Synonym: 3-Formyl-2-hydroxybenzoic acid hydrate,2-Hydroxyisophthalaldehyde acid hydrate IUPAC Name: 3-formyl-2-hydroxybenzoic acid SMILES: OC(=O)C1=CC=CC(C=O)=C1O

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Specifications

CAS	1266615-78-4
Molecular Weight (g/mol)	166.13
MDL Number	MFCD03804454
SMILES	OC(=O)C1=CC=CC(C=O)=C1O
Synonym	3-Formyl-2-hydroxybenzoic acid hydrate,2-Hydroxyisophthalaldehyde acid hydrate
IUPAC Name	3-formyl-2-hydroxybenzoic acid
InChI Key	YOEUNKPREOJHBW-UHFFFAOYSA-N
Molecular Formula	C8H6O4

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Witch Hazel, USP, Spectrum™ Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Choline Dihydrogen Citrate, 98%, Spectrum™ Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Witch Hazel, USP, Spectrum™ Chemical

Choline Dihydrogen Citrate, 98%, Spectrum™ Chemical