Unclassified Organic Compounds

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

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2,251 – 2,265 of 162,977 results

2,251

3,3'-Iminobis(N,N-dimethylpropylamine)

CAS: 6711-48-4 Molecular Formula: C10H25N3 Molecular Weight (g/mol): 187.33 InChI Key: BXYVQNNEFZOBOZ-UHFFFAOYSA-N IUPAC Name: (3-{[3-(dimethylamino)propyl]amino}propyl)dimethylamine SMILES: CN(C)CCCNCCCN(C)C

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Specifications

CAS	6711-48-4
Molecular Weight (g/mol)	187.33
SMILES	CN(C)CCCNCCCN(C)C
IUPAC Name	(3-{[3-(dimethylamino)propyl]amino}propyl)dimethylamine
InChI Key	BXYVQNNEFZOBOZ-UHFFFAOYSA-N
Molecular Formula	C10H25N3

2,252

Isopropylmagnesium bromide, 3M solution in 2-MeTHF, AcroSeal™

CAS: 920-39-8 Molecular Formula: C3H7BrMg Molecular Weight (g/mol): 147.30 MDL Number: MFCD00672110 InChI Key: UCJIVFREPMUZDC-UHFFFAOYSA-M Synonym: isopropylmagnesium bromide,magnesium, bromo 1-methylethyl,isopropylmagnesiumbromide,bromo 1-methylethyl magnesium,iprmgbr,i-prmgbr,bromoisopropylmagnesium,i-propylmagnesiumbromide,i-propylmagnesium bromide,bromo-isopropyl-magnesium,grignard reagent PubChem CID: 101909 IUPAC Name: magnesium;propane;bromide SMILES: CC(C)[Mg]Br

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Specifications

PubChem CID	101909
CAS	920-39-8
Molecular Weight (g/mol)	147.30
MDL Number	MFCD00672110
SMILES	CC(C)[Mg]Br
Synonym	isopropylmagnesium bromide,magnesium, bromo 1-methylethyl,isopropylmagnesiumbromide,bromo 1-methylethyl magnesium,iprmgbr,i-prmgbr,bromoisopropylmagnesium,i-propylmagnesiumbromide,i-propylmagnesium bromide,bromo-isopropyl-magnesium,grignard reagent
IUPAC Name	magnesium;propane;bromide
InChI Key	UCJIVFREPMUZDC-UHFFFAOYSA-M
Molecular Formula	C3H7BrMg

2,253

Lopinavir, 98%, Thermo Scientific Chemicals

CAS: 192725-17-0 Molecular Formula: C37H48N4O5 Molecular Weight (g/mol): 628.81 MDL Number: MFCD22628840 InChI Key: KJHKTHWMRKYKJE-SUGCFTRWSA-N PubChem CID: 133109001 IUPAC Name: N-[(2R,4R,5R)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide SMILES: CC(C)[C@H](N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)COC1=C(C)C=CC=C1C)CC1=CC=CC=C1

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Specifications

PubChem CID	133109001
CAS	192725-17-0
Molecular Weight (g/mol)	628.81
MDL Number	MFCD22628840
SMILES	CC(C)[C@H](N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)COC1=C(C)C=CC=C1C)CC1=CC=CC=C1
IUPAC Name	N-[(2R,4R,5R)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
InChI Key	KJHKTHWMRKYKJE-SUGCFTRWSA-N
Molecular Formula	C37H48N4O5

2,254

Calcium acetate hydrate, 99%

CAS: 114460-21-8 Molecular Formula: C4H6CaO4 Molecular Weight (g/mol): 158.17 MDL Number: MFCD00012448 InChI Key: VSGNNIFQASZAOI-UHFFFAOYSA-L IUPAC Name: calcium diacetate SMILES: [Ca++].CC([O-])=O.CC([O-])=O

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Specifications

CAS	114460-21-8
Molecular Weight (g/mol)	158.17
MDL Number	MFCD00012448
SMILES	[Ca++].CC([O-])=O.CC([O-])=O
IUPAC Name	calcium diacetate
InChI Key	VSGNNIFQASZAOI-UHFFFAOYSA-L
Molecular Formula	C4H6CaO4

2,255

Orlistat, 98%

CAS: 96829-58-2 Molecular Formula: C29H53NO5 Molecular Weight (g/mol): 495.75 MDL Number: MFCD05662360 InChI Key: AHLBNYSZXLDEJQ-FWEHEUNISA-N Synonym: orlistat,tetrahydrolipstatin,xenical,alli,orlipastat,--tetrahydrolipstatin,orlipastatum,orlipastatum inn-latin,thlp,tetrahydrolipastatin PubChem CID: 3034010 IUPAC Name: (2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl (2S)-2-formamido-4-methylpentanoate SMILES: CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O

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Specifications

PubChem CID	3034010
CAS	96829-58-2
Molecular Weight (g/mol)	495.75
MDL Number	MFCD05662360
SMILES	CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O
Synonym	orlistat,tetrahydrolipstatin,xenical,alli,orlipastat,--tetrahydrolipstatin,orlipastatum,orlipastatum inn-latin,thlp,tetrahydrolipastatin
IUPAC Name	(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl (2S)-2-formamido-4-methylpentanoate
InChI Key	AHLBNYSZXLDEJQ-FWEHEUNISA-N
Molecular Formula	C29H53NO5

2,256

Thermo Scientific Chemicals Ethyl cellulose

CAS: 9004-57-3 Molecular Formula: C23H24N6O4 Molecular Weight (g/mol): 448.483 MDL Number: MFCD00131037 InChI Key: ARSKJXYLLONUAJ-UHFFFAOYSA-N Synonym: n-butyl-n-2-acetoxyethyl-4-4-nitro-2,6-dicyanophenyl azo-3-methylbenzeneamine,1,3-benzenedicarbonitrile, 2-4-2-acetyloxy ethyl butylamino-2-methylphenyl azo-5-nitro,1,3-benzenedicarbonitrile, 2-2-4-2-acetyloxy ethyl butylamino-2-methylphenyl diazenyl-5-nitro,azo dye n5,4-2,6-dicyano-4-nitrophenyl azo-3-methylphenyl amino hexyl acetate,ethyl cellulose, viscosity ethoxyl,2-n-butyl-4-2,6-dicyano-4-nitrophenyl diazenyl-3-methylanilino ethyl acetate,4-n-2-acetoxyethyl butyl amino-2',6'-dicyano-2-methyl-4'-nitroazobenzene PubChem CID: 166304 IUPAC Name: 2-[N-butyl-4-[(2,6-dicyano-4-nitrophenyl)diazenyl]-3-methylanilino]ethyl acetate SMILES: CCCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)C

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Specifications

PubChem CID	166304
CAS	9004-57-3
Molecular Weight (g/mol)	448.483
MDL Number	MFCD00131037
SMILES	CCCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)C
Synonym	n-butyl-n-2-acetoxyethyl-4-4-nitro-2,6-dicyanophenyl azo-3-methylbenzeneamine,1,3-benzenedicarbonitrile, 2-4-2-acetyloxy ethyl butylamino-2-methylphenyl azo-5-nitro,1,3-benzenedicarbonitrile, 2-2-4-2-acetyloxy ethyl butylamino-2-methylphenyl diazenyl-5-nitro,azo dye n5,4-2,6-dicyano-4-nitrophenyl azo-3-methylphenyl amino hexyl acetate,ethyl cellulose, viscosity ethoxyl,2-n-butyl-4-2,6-dicyano-4-nitrophenyl diazenyl-3-methylanilino ethyl acetate,4-n-2-acetoxyethyl butyl amino-2',6'-dicyano-2-methyl-4'-nitroazobenzene
IUPAC Name	2-[N-butyl-4-[(2,6-dicyano-4-nitrophenyl)diazenyl]-3-methylanilino]ethyl acetate
InChI Key	ARSKJXYLLONUAJ-UHFFFAOYSA-N
Molecular Formula	C23H24N6O4

2,257

Thermo Scientific Chemicals D-Fructose 1,6-bisphosphate trisodium salt octahydrate, 98%

CAS: 81028-91-3 Molecular Formula: C6H26Na3O20P2 Molecular Weight (g/mol): 549.17 MDL Number: MFCD00149340,MFCD00135870,MFCD00068321 InChI Key: DBTJWGHAMYSWQR-OLMHPWOBSA-J Synonym: FDP-Na3H IUPAC Name: trisodium octahydrate [(3S,4S,5R)-2,3,4-trihydroxy-5-[(phosphonatooxy)methyl]oxolan-2-yl]methyl phosphate SMILES: O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].O[C@H]1[C@H](O)C(O)(COP([O-])([O-])=O)O[C@@H]1COP([O-])([O-])=O

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Specifications

CAS	81028-91-3
Molecular Weight (g/mol)	549.17
MDL Number	MFCD00149340,MFCD00135870,MFCD00068321
SMILES	O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].O[C@H]1[C@H](O)C(O)(COP([O-])([O-])=O)O[C@@H]1COP([O-])([O-])=O
Synonym	FDP-Na3H
IUPAC Name	trisodium octahydrate [(3S,4S,5R)-2,3,4-trihydroxy-5-[(phosphonatooxy)methyl]oxolan-2-yl]methyl phosphate
InChI Key	DBTJWGHAMYSWQR-OLMHPWOBSA-J
Molecular Formula	C6H26Na3O20P2

2,258

2-Acetamidoacrylic acid, 97+%

CAS: 5429-56-1 Molecular Formula: C5H7NO3 Molecular Weight (g/mol): 129.115 MDL Number: MFCD00004257 InChI Key: UFDFFEMHDKXMBG-UHFFFAOYSA-N Synonym: 2-acetamidoacrylic acid,2-propenoic acid, 2-acetylamino,acrylic acid, 2-acetamido,2-acetamidoacrylicacid,acetyldehydroalanine,n-acetyldehydroalanine,2-acetylamino acrylic acid,.alpha.-acetamidoacrylic acid,2-acetylamino-2-propenoic acid,2-acetylamino prop-2-enoic acid PubChem CID: 79482 IUPAC Name: 2-acetamidoprop-2-enoic acid SMILES: CC(=O)NC(=C)C(=O)O

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Specifications

PubChem CID	79482
CAS	5429-56-1
Molecular Weight (g/mol)	129.115
MDL Number	MFCD00004257
SMILES	CC(=O)NC(=C)C(=O)O
Synonym	2-acetamidoacrylic acid,2-propenoic acid, 2-acetylamino,acrylic acid, 2-acetamido,2-acetamidoacrylicacid,acetyldehydroalanine,n-acetyldehydroalanine,2-acetylamino acrylic acid,.alpha.-acetamidoacrylic acid,2-acetylamino-2-propenoic acid,2-acetylamino prop-2-enoic acid
IUPAC Name	2-acetamidoprop-2-enoic acid
InChI Key	UFDFFEMHDKXMBG-UHFFFAOYSA-N
Molecular Formula	C5H7NO3

2,259

Thermo Scientific™ L-(+)-Ergothioneine, 98+%

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2,260

Thermo Scientific Chemicals Ethylenediamine-N,N'-diacetic acid

CAS: 5657-17-0 Molecular Formula: C6H10N2Na2O4 Molecular Weight (g/mol): 220.14 MDL Number: MFCD00004281 InChI Key: QMIFISRIAJBCGZ-UHFFFAOYSA-L Synonym: edda,ethylenediamine-n,n'-diacetic acid,n,n'-ethylenediglycine,glycine, n,n'-1,2-ethanediylbis,ethylenediaminediacetic acid,glycine, n,n'-ethylenedi,unii-4lx0u5342u,2-2-carboxymethylamino ethylamino acetic acid,ethylenediamine-n,n'-diaceticacid,ethylenediamine-n,n'-di acetic acid PubChem CID: 61975 SMILES: [Na+].[Na+].[O-]C(=O)CNCCNCC([O-])=O

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Specifications

PubChem CID	61975
CAS	5657-17-0
Molecular Weight (g/mol)	220.14
MDL Number	MFCD00004281
SMILES	[Na+].[Na+].[O-]C(=O)CNCCNCC([O-])=O
Synonym	edda,ethylenediamine-n,n'-diacetic acid,n,n'-ethylenediglycine,glycine, n,n'-1,2-ethanediylbis,ethylenediaminediacetic acid,glycine, n,n'-ethylenedi,unii-4lx0u5342u,2-2-carboxymethylamino ethylamino acetic acid,ethylenediamine-n,n'-diaceticacid,ethylenediamine-n,n'-di acetic acid
InChI Key	QMIFISRIAJBCGZ-UHFFFAOYSA-L
Molecular Formula	C6H10N2Na2O4

2,261

p-Chloranil, 97%

CAS: 118-75-2 Molecular Formula: C6Cl4O2 Molecular Weight (g/mol): 245.86 MDL Number: MFCD00001594 InChI Key: UGNWTBMOAKPKBL-UHFFFAOYSA-N Synonym: chloranil,p-chloranil,tetrachloro-p-benzoquinone,tetrachloro-1,4-benzoquinone,tetrachlorobenzoquinone,spergon,coversan,reranil,vulklor,2,3,5,6-tetrachloro-1,4-benzoquinone PubChem CID: 8371 ChEBI: CHEBI:36703 IUPAC Name: 2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione SMILES: ClC1=C(Cl)C(=O)C(Cl)=C(Cl)C1=O

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Specifications

PubChem CID	8371
CAS	118-75-2
Molecular Weight (g/mol)	245.86
ChEBI	CHEBI:36703
MDL Number	MFCD00001594
SMILES	ClC1=C(Cl)C(=O)C(Cl)=C(Cl)C1=O
Synonym	chloranil,p-chloranil,tetrachloro-p-benzoquinone,tetrachloro-1,4-benzoquinone,tetrachlorobenzoquinone,spergon,coversan,reranil,vulklor,2,3,5,6-tetrachloro-1,4-benzoquinone
IUPAC Name	2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione
InChI Key	UGNWTBMOAKPKBL-UHFFFAOYSA-N
Molecular Formula	C6Cl4O2

2,262

Ethyl (S)-(-)-1-Boc-4-oxopiperidine-2-carboxylate, 95%, Thermo Scientific Chemicals

CAS: 180854-44-8 Molecular Formula: C13H21NO5 Molecular Weight (g/mol): 271.313 MDL Number: MFCD15071881 InChI Key: YAVQLRUBKDCOCI-JTQLQIEISA-N Synonym: ethyl s-1-boc-4-oxopiperidine-2-carboxylate,s-1-tert-butyl 2-ethyl 4-oxopiperidine-1,2-dicarboxylate,1-tert-butyl 2-ethyl 2s-4-oxopiperidine-1,2-dicarboxylate,ethyl r-+-1-boc-4-oxopiperidine-2-carboxylate,ethyl s---1-boc-4-oxopiperidine-2-carboxylate,ethyl s-n-tert-butoxycarbonyl-4-oxo-2-pipecolate,o1-tert-butyl o2-ethyl 2s-4-oxopiperidine-1,2-dicarboxylate,2s-4-oxopiperidine-1,2-dicarboxylic acid 1-tert-butyl 2-ethyl ester PubChem CID: 11369276 IUPAC Name: 1-O-tert-butyl 2-O-ethyl (2S)-4-oxopiperidine-1,2-dicarboxylate SMILES: CCOC(=O)C1CC(=O)CCN1C(=O)OC(C)(C)C

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Specifications

PubChem CID	11369276
CAS	180854-44-8
Molecular Weight (g/mol)	271.313
MDL Number	MFCD15071881
SMILES	CCOC(=O)C1CC(=O)CCN1C(=O)OC(C)(C)C
Synonym	ethyl s-1-boc-4-oxopiperidine-2-carboxylate,s-1-tert-butyl 2-ethyl 4-oxopiperidine-1,2-dicarboxylate,1-tert-butyl 2-ethyl 2s-4-oxopiperidine-1,2-dicarboxylate,ethyl r-+-1-boc-4-oxopiperidine-2-carboxylate,ethyl s---1-boc-4-oxopiperidine-2-carboxylate,ethyl s-n-tert-butoxycarbonyl-4-oxo-2-pipecolate,o1-tert-butyl o2-ethyl 2s-4-oxopiperidine-1,2-dicarboxylate,2s-4-oxopiperidine-1,2-dicarboxylic acid 1-tert-butyl 2-ethyl ester
IUPAC Name	1-O-tert-butyl 2-O-ethyl (2S)-4-oxopiperidine-1,2-dicarboxylate
InChI Key	YAVQLRUBKDCOCI-JTQLQIEISA-N
Molecular Formula	C13H21NO5

2,263

N-Boc-N-methyl-L-alanine, 98%

CAS: 16948-16-6 Molecular Formula: C9H17NO4 Molecular Weight (g/mol): 203.24 MDL Number: MFCD00037242 InChI Key: VLHQXRIIQSTJCQ-LURJTMIESA-N Synonym: boc-n-me-ala-oh,boc-n-methyl-l-alanine,n-boc-n-methyl-l-alanine,s-2-tert-butoxycarbonyl methyl amino propanoic acid,n-tert-butoxycarbonyl-n-methyl-l-alanine,boc-n-a-methyl-l-alanine,s-2-tert-butoxycarbonyl-methyl-amino-propionic acid,l-alanine, n-1,1-dimethylethoxy carbonyl-n-methyl,2s-2-tert-butoxycarbonyl methyl amino propanoic acid,2s-2-tert-butoxy carbonyl methyl amino propanoic acid PubChem CID: 7009590 IUPAC Name: (2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid SMILES: C[C@H](N(C)C(=O)OC(C)(C)C)C(O)=O

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Specifications

PubChem CID	7009590
CAS	16948-16-6
Molecular Weight (g/mol)	203.24
MDL Number	MFCD00037242
SMILES	C[C@H](N(C)C(=O)OC(C)(C)C)C(O)=O
Synonym	boc-n-me-ala-oh,boc-n-methyl-l-alanine,n-boc-n-methyl-l-alanine,s-2-tert-butoxycarbonyl methyl amino propanoic acid,n-tert-butoxycarbonyl-n-methyl-l-alanine,boc-n-a-methyl-l-alanine,s-2-tert-butoxycarbonyl-methyl-amino-propionic acid,l-alanine, n-1,1-dimethylethoxy carbonyl-n-methyl,2s-2-tert-butoxycarbonyl methyl amino propanoic acid,2s-2-tert-butoxy carbonyl methyl amino propanoic acid
IUPAC Name	(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
InChI Key	VLHQXRIIQSTJCQ-LURJTMIESA-N
Molecular Formula	C9H17NO4

2,264

DL-Buthionine (S,R)-sulfoximine, 99%

CAS: 5072-26-4 Molecular Formula: C8H18N2O3S Molecular Weight (g/mol): 222.30 MDL Number: MFCD00070309 InChI Key: KJQFBVYMGADDTQ-UHFFFAOYNA-N Synonym: buthionine sulfoximine,dl-buthionine-s,r-sulfoximine,buthionine sulfoxamine,buthione sulfoximine,buthionine-s,r-sulfoximine,2-amino-4-s-butylsulfonimidoyl butanoic acid,butionine sulfoximine,buthionine sulphoximine,2-amino-4-butylsulfonimidoyl butanoic acid,butanoic acid, 2-amino-4-s-butylsulfonimidoyl PubChem CID: 21157 ChEBI: CHEBI:28714 IUPAC Name: 2-amino-4-(butylsulfonimidoyl)butanoic acid SMILES: CCCCS(=N)(=O)CCC(N)C(O)=O

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Specifications

PubChem CID	21157
CAS	5072-26-4
Molecular Weight (g/mol)	222.30
ChEBI	CHEBI:28714
MDL Number	MFCD00070309
SMILES	CCCCS(=N)(=O)CCC(N)C(O)=O
Synonym	buthionine sulfoximine,dl-buthionine-s,r-sulfoximine,buthionine sulfoxamine,buthione sulfoximine,buthionine-s,r-sulfoximine,2-amino-4-s-butylsulfonimidoyl butanoic acid,butionine sulfoximine,buthionine sulphoximine,2-amino-4-butylsulfonimidoyl butanoic acid,butanoic acid, 2-amino-4-s-butylsulfonimidoyl
IUPAC Name	2-amino-4-(butylsulfonimidoyl)butanoic acid
InChI Key	KJQFBVYMGADDTQ-UHFFFAOYNA-N
Molecular Formula	C8H18N2O3S

2,265

Guanidine carbonate, 98%

CAS: 593-85-1 Molecular Formula: C₃H₁₂N₆O₃ MDL Number: MFCD00013029

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Specifications

CAS	593-85-1
MDL Number	MFCD00013029
Molecular Formula	C₃H₁₂N₆O₃

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