Unclassified Organic Compounds

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

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1,561 – 1,575 of 202,494 results

1,561

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N-Fmoc-L-aspartic acid 4-tert-butyl ester, 98%

CAS: 71989-14-5 Molecular Formula: C23H25NO6 Molecular Weight (g/mol): 411.454 MDL Number: MFCD00037131 InChI Key: FODJWPHPWBKDON-IBGZPJMESA-N Synonym: fmoc-asp otbu-oh,s-2-9h-fluoren-9-yl methoxy carbonyl amino-4-tert-butoxy-4-oxobutanoic acid,fmoc-asp obut,fmoc-l-aspartic acid beta-tert-butyl ester,fmoc-asp ot-bu-oh,fmoc-l-asp tbu,fmocasp otbu-oh,fmoc-asp obu-oh,fmoc-asp tbu-oh,fmoc-l-aspartic acid 4-tert-butyl ester PubChem CID: 2724635 IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid SMILES: CC(C)(C)OC(=O)CC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

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PubChem CID	2724635
CAS	71989-14-5
Molecular Weight (g/mol)	411.454
MDL Number	MFCD00037131
SMILES	CC(C)(C)OC(=O)CC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
Synonym	fmoc-asp otbu-oh,s-2-9h-fluoren-9-yl methoxy carbonyl amino-4-tert-butoxy-4-oxobutanoic acid,fmoc-asp obut,fmoc-l-aspartic acid beta-tert-butyl ester,fmoc-asp ot-bu-oh,fmoc-l-asp tbu,fmocasp otbu-oh,fmoc-asp obu-oh,fmoc-asp tbu-oh,fmoc-l-aspartic acid 4-tert-butyl ester
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
InChI Key	FODJWPHPWBKDON-IBGZPJMESA-N
Molecular Formula	C23H25NO6

1,562

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7-Fluoro-6-nitro-3,4-dihydro-2H-1,4-benzoxazine, 97%, Thermo Scientific Chemicals

CAS: 122138-83-4 Molecular Formula: C8H7FN2O3 Molecular Weight (g/mol): 198.153 MDL Number: MFCD23379858 InChI Key: PEOVRVSERLAIQM-UHFFFAOYSA-N PubChem CID: 14422956 IUPAC Name: 7-fluoro-6-nitro-3,4-dihydro-2H-1,4-benzoxazine SMILES: C1COC2=CC(=C(C=C2N1)[N+](=O)[O-])F

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PubChem CID	14422956
CAS	122138-83-4
Molecular Weight (g/mol)	198.153
MDL Number	MFCD23379858
SMILES	C1COC2=CC(=C(C=C2N1)[N+](=O)[O-])F
IUPAC Name	7-fluoro-6-nitro-3,4-dihydro-2H-1,4-benzoxazine
InChI Key	PEOVRVSERLAIQM-UHFFFAOYSA-N
Molecular Formula	C8H7FN2O3

1,563

Concanavalin A, MP Biomedicals™

CAS: 11028-71-0 Synonym: Con A

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CAS	11028-71-0
Synonym	Con A

1,564

Adenosine-5'-Diphosphate Monopotassium Salt Dihydrate, MP Biomedicals™

CAS: 72696-48-1 Molecular Formula: C10H14KN5O10P2 Molecular Weight (g/mol): 465.29 MDL Number: MFCD00066472 InChI Key: ZNCWUOPIJTUALR-GWKNMROSNA-M Synonym: adenosine 5-diphosphate monopotassium salt dihydrate PubChem CID: 131675483 IUPAC Name: potassium (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-({[(hydrogen phosphonatooxy)(hydroxy)phosphoryl]oxy}methyl)oxolane-3,4-diol SMILES: [K+].NC1=C2N=CN([C@@H]3O[C@H](COP(O)(=O)OP(O)([O-])=O)[C@@H](O)[C@H]3O)C2=NC=N1

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PubChem CID	131675483
CAS	72696-48-1
Molecular Weight (g/mol)	465.29
MDL Number	MFCD00066472
SMILES	[K+].NC1=C2N=CN([C@@H]3O[C@H](COP(O)(=O)OP(O)([O-])=O)[C@@H](O)[C@H]3O)C2=NC=N1
Synonym	adenosine 5-diphosphate monopotassium salt dihydrate
IUPAC Name	potassium (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-({[(hydrogen phosphonatooxy)(hydroxy)phosphoryl]oxy}methyl)oxolane-3,4-diol
InChI Key	ZNCWUOPIJTUALR-GWKNMROSNA-M
Molecular Formula	C10H14KN5O10P2

1,565

L-Methionine, MP Biomedicals™

CAS: 63-68-3 Molecular Formula: C5H11NO2S Molecular Weight (g/mol): 149.21 MDL Number: MFCD00063097 MFCD00801344 InChI Key: FFEARJCKVFRZRR-BYPYZUCNSA-N Synonym: l-methionine,methionine,h-met-oh,s-2-amino-4-methylthio butanoic acid,cymethion,l---methionine,liquimeth,s-methionine,l-methioninum,methilanin PubChem CID: 6137 ChEBI: CHEBI:16643 IUPAC Name: (2S)-2-amino-4-(methylsulfanyl)butanoic acid SMILES: CSCC[C@H](N)C(O)=O

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PubChem CID	6137
CAS	63-68-3
Molecular Weight (g/mol)	149.21
ChEBI	CHEBI:16643
MDL Number	MFCD00063097 MFCD00801344
SMILES	CSCC[C@H](N)C(O)=O
Synonym	l-methionine,methionine,h-met-oh,s-2-amino-4-methylthio butanoic acid,cymethion,l---methionine,liquimeth,s-methionine,l-methioninum,methilanin
IUPAC Name	(2S)-2-amino-4-(methylsulfanyl)butanoic acid
InChI Key	FFEARJCKVFRZRR-BYPYZUCNSA-N
Molecular Formula	C5H11NO2S

1,566

Glyceryl Monooleate, MP Biomedicals™

CAS: 111-03-5 Molecular Formula: C21H40O4 Molecular Weight (g/mol): 356.547 InChI Key: RZRNAYUHWVFMIP-KTKRTIGZSA-N Synonym: monoolein,glyceryl monooleate,2,3-dihydroxypropyl oleate,1-monoolein,1-oleoylglycerol,1-oleoyl-rac-glycerol,glyceryl oleate,1-glyceryl oleate,1-monooleoylglycerol,glycerol 1-monooleate PubChem CID: 5283468 ChEBI: CHEBI:75342 IUPAC Name: 2,3-dihydroxypropyl (Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O

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Specifications

PubChem CID	5283468
CAS	111-03-5
Molecular Weight (g/mol)	356.547
ChEBI	CHEBI:75342
SMILES	CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O
Synonym	monoolein,glyceryl monooleate,2,3-dihydroxypropyl oleate,1-monoolein,1-oleoylglycerol,1-oleoyl-rac-glycerol,glyceryl oleate,1-glyceryl oleate,1-monooleoylglycerol,glycerol 1-monooleate
IUPAC Name	2,3-dihydroxypropyl (Z)-octadec-9-enoate
InChI Key	RZRNAYUHWVFMIP-KTKRTIGZSA-N
Molecular Formula	C21H40O4

1,567

N-Acetyl-D-Glucosamine, MP Biomedicals™

CAS: 7512-17-6 Molecular Formula: C8H15NO6 Molecular Weight (g/mol): 221.21 MDL Number: MFCD00061615 InChI Key: OVRNDRQMDRJTHS-WZWLWIOANA-N Synonym: 2-Acetamido-2-deoxy-D-glucose, D-GlcNAc IUPAC Name: N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide SMILES: CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O

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Specifications

CAS	7512-17-6
Molecular Weight (g/mol)	221.21
MDL Number	MFCD00061615
SMILES	CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
Synonym	2-Acetamido-2-deoxy-D-glucose, D-GlcNAc
IUPAC Name	N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
InChI Key	OVRNDRQMDRJTHS-WZWLWIOANA-N
Molecular Formula	C8H15NO6

1,568

Trypsin, 1-250 from Porcine Pancreas , MP Biomedicals, LLC

CAS: 7-7-9002 Molecular Formula: C35H47N7O10 Molecular Weight (g/mol): 725.80 InChI Key: WGWZNYKOUXOZTC-UHFFFAOYNA-N Synonym: tryptase,trypsin,tryptase from human lung,tryptase from human lung, buffered aqueous solution, ≥5 units/mg protein,acetic acid; tert-butyl n-2s-1-2s-1-2s-5-diaminomethylideneamino-1-5-methyl-2-oxochromen-7-yl amino-1-oxopentan-2-yl amino-3-hydroxy-1-oxopropan-2-yl amino-1-oxo-3-phenylpropan-2-yl carbamate PubChem CID: 5311489

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PubChem CID	5311489
CAS	7-7-9002
Molecular Weight (g/mol)	725.80
Synonym	tryptase,trypsin,tryptase from human lung,tryptase from human lung, buffered aqueous solution, ≥5 units/mg protein,acetic acid; tert-butyl n-2s-1-2s-1-2s-5-diaminomethylideneamino-1-5-methyl-2-oxochromen-7-yl amino-1-oxopentan-2-yl amino-3-hydroxy-1-oxopropan-2-yl amino-1-oxo-3-phenylpropan-2-yl carbamate
InChI Key	WGWZNYKOUXOZTC-UHFFFAOYNA-N
Molecular Formula	C35H47N7O10

1,569

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N-Formyl-D-leucine, tech. 90%, Thermo Scientific Chemicals

CAS: 44978-39-4 Molecular Formula: C7H13NO3 Molecular Weight (g/mol): 159.19 MDL Number: MFCD08275788 InChI Key: HFBHOAHFRNLZGN-MDOHGIEYNA-N Synonym: n-alpha-formyl-d-leucine,2r-2-formamido-4-methylpentanoic acid,r-2-formamido-4-methylpentanoic acid,formyl-d-leucin,n-formyl-d-leucine,d-leucine, n-formyl,r-2-formylamino-4-methylpentanoic acid PubChem CID: 13025456 IUPAC Name: (2R)-2-formamido-4-methylpentanoic acid SMILES: CC(C)C[C@@H](NC=O)C(O)=O

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Specifications

PubChem CID	13025456
CAS	44978-39-4
Molecular Weight (g/mol)	159.19
MDL Number	MFCD08275788
SMILES	CC(C)C[C@@H](NC=O)C(O)=O
Synonym	n-alpha-formyl-d-leucine,2r-2-formamido-4-methylpentanoic acid,r-2-formamido-4-methylpentanoic acid,formyl-d-leucin,n-formyl-d-leucine,d-leucine, n-formyl,r-2-formylamino-4-methylpentanoic acid
IUPAC Name	(2R)-2-formamido-4-methylpentanoic acid
InChI Key	HFBHOAHFRNLZGN-MDOHGIEYNA-N
Molecular Formula	C7H13NO3

1,570

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Thermo Scientific Chemicals Lomustine

CAS: 13010-47-4 Molecular Formula: C9H16ClN3O2 Molecular Weight (g/mol): 233.70 MDL Number: MFCD00012392 InChI Key: GQYIWUVLTXOXAJ-UHFFFAOYSA-N IUPAC Name: 3-(2-chloroethyl)-1-cyclohexyl-3-nitrosourea SMILES: ClCCN(N=O)C(=O)NC1CCCCC1

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Specifications

CAS	13010-47-4
Molecular Weight (g/mol)	233.70
MDL Number	MFCD00012392
SMILES	ClCCN(N=O)C(=O)NC1CCCCC1
IUPAC Name	3-(2-chloroethyl)-1-cyclohexyl-3-nitrosourea
InChI Key	GQYIWUVLTXOXAJ-UHFFFAOYSA-N
Molecular Formula	C9H16ClN3O2

1,571

Chlorhexidine Diacetate, MP Biomedicals™

CAS: 56-95-1 Molecular Formula: C26H38Cl2N10O4 Molecular Weight (g/mol): 625.56 MDL Number: MFCD00150042 InChI Key: WDRFFJWBUDTUCA-UHFFFAOYSA-N Synonym: chlorhexidine acetate hydrate 1:2:x,chlorhexidine diacetate salt monohydrate,chlorhexidine diacetate monohydrate,1,1 inverted exclamation marka-hexamethylenebis 5-4-chlorophenyl biguanide diacetate salt,4-chlorophenyl 6-4-chlorophenyl amino iminomethyl amino iminomethy l amino hexyl amino iminomethyl amino iminomethyl amine, acetic acid, acetic a cid, oxamethane PubChem CID: 43834499 IUPAC Name: acetic acid;(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;hydrate SMILES: CC(O)=O.CC(O)=O.NC(NC1=CC=C(Cl)C=C1)=NC(N)=NCCCCCCN=C(N)N=C(N)NC1=CC=C(Cl)C=C1

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PubChem CID	43834499
CAS	56-95-1
Molecular Weight (g/mol)	625.56
MDL Number	MFCD00150042
SMILES	CC(O)=O.CC(O)=O.NC(NC1=CC=C(Cl)C=C1)=NC(N)=NCCCCCCN=C(N)N=C(N)NC1=CC=C(Cl)C=C1
Synonym	chlorhexidine acetate hydrate 1:2:x,chlorhexidine diacetate salt monohydrate,chlorhexidine diacetate monohydrate,1,1 inverted exclamation marka-hexamethylenebis 5-4-chlorophenyl biguanide diacetate salt,4-chlorophenyl 6-4-chlorophenyl amino iminomethyl amino iminomethy l amino hexyl amino iminomethyl amino iminomethyl amine, acetic acid, acetic a cid, oxamethane
IUPAC Name	acetic acid;(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;hydrate
InChI Key	WDRFFJWBUDTUCA-UHFFFAOYSA-N
Molecular Formula	C26H38Cl2N10O4

1,572

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3-Methylhippuric acid, 97%

CAS: 27115-49-7 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00044399 InChI Key: YKAKNMHEIJUKEX-UHFFFAOYSA-N Synonym: 3-methylhippuric acid,m-methylhippuric acid,n-m-toluoyl glycine,m-toluric acid,n-3-methylbenzoyl glycine,3-methylbenzoylglycine,glycine, n-3-methylbenzoyl,meta-methylhippuric acid,hippuric acid, m-methyl,3-methyl hippuric acid PubChem CID: 99223 ChEBI: CHEBI:68500 SMILES: CC1=CC=CC(=C1)C(=O)NCC(O)=O

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PubChem CID	99223
CAS	27115-49-7
Molecular Weight (g/mol)	193.20
ChEBI	CHEBI:68500
MDL Number	MFCD00044399
SMILES	CC1=CC=CC(=C1)C(=O)NCC(O)=O
Synonym	3-methylhippuric acid,m-methylhippuric acid,n-m-toluoyl glycine,m-toluric acid,n-3-methylbenzoyl glycine,3-methylbenzoylglycine,glycine, n-3-methylbenzoyl,meta-methylhippuric acid,hippuric acid, m-methyl,3-methyl hippuric acid
InChI Key	YKAKNMHEIJUKEX-UHFFFAOYSA-N
Molecular Formula	C10H11NO3

1,573

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2-Chloro-1,3-dimethylimidazolium tetrafluoroborate, 98+%, Thermo Scientific Chemicals

CAS: 153433-26-2 Molecular Formula: C5H10BClF4N2 Molecular Weight (g/mol): 220.40 MDL Number: MFCD09039291 InChI Key: UPLXKEIRISBKRM-UHFFFAOYSA-N Synonym: CIB IUPAC Name: 2-chloro-1,3-dimethyl-4,5-dihydro-1H-imidazol-3-ium; tetrafluoroboranuide SMILES: F[B-](F)(F)F.CN1CC[N+](C)=C1Cl

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CAS	153433-26-2
Molecular Weight (g/mol)	220.40
MDL Number	MFCD09039291
SMILES	F[B-](F)(F)F.CN1CC[N+](C)=C1Cl
Synonym	CIB
IUPAC Name	2-chloro-1,3-dimethyl-4,5-dihydro-1H-imidazol-3-ium; tetrafluoroboranuide
InChI Key	UPLXKEIRISBKRM-UHFFFAOYSA-N
Molecular Formula	C5H10BClF4N2

1,574

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4-Bromo-2-(5-isoxazolyl)phenol, 97%

CAS: 213690-27-8 Molecular Formula: C9H6BrNO2 Molecular Weight (g/mol): 240.06 MDL Number: MFCD00799493 InChI Key: GBXOJTWVFYSJRI-UHFFFAOYSA-N Synonym: 4-bromo-2-5-isoxazolyl phenol,4-bromo-6-2h-1,2-oxazol-5-ylidene cyclohexa-2,4-dien-1-one,4-bromo-2-1,2-oxazol-5-yl phenol,acmc-1ckhc,4-bromo-2-isoxazole-5-yl phenol,phenol,4-bromo-2-5-isoxazolyl PubChem CID: 6744794 IUPAC Name: 4-bromo-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one SMILES: BrC1=CC(=C2ONC=C2)C(=O)C=C1

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PubChem CID	6744794
CAS	213690-27-8
Molecular Weight (g/mol)	240.06
MDL Number	MFCD00799493
SMILES	BrC1=CC(=C2ONC=C2)C(=O)C=C1
Synonym	4-bromo-2-5-isoxazolyl phenol,4-bromo-6-2h-1,2-oxazol-5-ylidene cyclohexa-2,4-dien-1-one,4-bromo-2-1,2-oxazol-5-yl phenol,acmc-1ckhc,4-bromo-2-isoxazole-5-yl phenol,phenol,4-bromo-2-5-isoxazolyl
IUPAC Name	4-bromo-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one
InChI Key	GBXOJTWVFYSJRI-UHFFFAOYSA-N
Molecular Formula	C9H6BrNO2

1,575

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4-cis-Fluoro-L-prolinamide hydrochloride, 98%

CAS: 426844-23-7 Molecular Formula: C5H10ClFN2O Molecular Weight (g/mol): 168.596 MDL Number: MFCD07368567 InChI Key: YIEACUBSPQGCLW-MMALYQPHSA-N Synonym: 2s,4s-4-fluoropyrrolidine-2-carboxamide hydrochloride,4-cis-fluoro-l-prolinamide hydrochloride,2s,4s-4-fluoropyrrolidine-2-carboxamide hcl,cis-4-fluoro-l-prolinamide hydrochloride,2s,4s-4-fluoro-2-pyrrolidinecarboxamide hydrochloride,4s-4-fluoro-l-prolinamide-hydrogen chloride 1/1,2s,4s-2-carbamoyl-4-fluoropyrrolidine hydrochloride salt,2s,4s-4-fluoropyrrolidine-2-carboxamide monohydrochloride,2s,4s-2-aminocarbonyl-4-fluoropyrrolidine hydrochloride PubChem CID: 45158917 IUPAC Name: (2S,4S)-4-fluoropyrrolidine-2-carboxamide;hydrochloride SMILES: C1C(CNC1C(=O)N)F.Cl

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Specifications

PubChem CID	45158917
CAS	426844-23-7
Molecular Weight (g/mol)	168.596
MDL Number	MFCD07368567
SMILES	C1C(CNC1C(=O)N)F.Cl
Synonym	2s,4s-4-fluoropyrrolidine-2-carboxamide hydrochloride,4-cis-fluoro-l-prolinamide hydrochloride,2s,4s-4-fluoropyrrolidine-2-carboxamide hcl,cis-4-fluoro-l-prolinamide hydrochloride,2s,4s-4-fluoro-2-pyrrolidinecarboxamide hydrochloride,4s-4-fluoro-l-prolinamide-hydrogen chloride 1/1,2s,4s-2-carbamoyl-4-fluoropyrrolidine hydrochloride salt,2s,4s-4-fluoropyrrolidine-2-carboxamide monohydrochloride,2s,4s-2-aminocarbonyl-4-fluoropyrrolidine hydrochloride
IUPAC Name	(2S,4S)-4-fluoropyrrolidine-2-carboxamide;hydrochloride
InChI Key	YIEACUBSPQGCLW-MMALYQPHSA-N
Molecular Formula	C5H10ClFN2O

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