Unclassified Organic Compounds

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

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1,321 – 1,335 of 163,002 results

1,321

Thermo Scientific Chemicals 2'-Deoxyguanosine 5'-monophosphate, sodium salt hydrate, 99%

CAS: 52558-16-4 Molecular Formula: C10H12N5Na2O7P Molecular Weight (g/mol): 391.19 MDL Number: MFCD00150780 InChI Key: CTPAMSRBXKGZCJ-WJQTVUBHNA-L Synonym: deoxyguanosine monophosphate tetrahydrate sodium salt PubChem CID: 131854716 IUPAC Name: [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate;sodium;tetrahydrate SMILES: [Na+].[Na+].NC1=NC2=C(N=CN2[C@H]2C[C@H](O)[C@@H](COP([O-])([O-])=O)O2)C(=O)N1

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Specifications

PubChem CID	131854716
CAS	52558-16-4
Molecular Weight (g/mol)	391.19
MDL Number	MFCD00150780
SMILES	[Na+].[Na+].NC1=NC2=C(N=CN2[C@H]2C[C@H](O)[C@@H](COP([O-])([O-])=O)O2)C(=O)N1
Synonym	deoxyguanosine monophosphate tetrahydrate sodium salt
IUPAC Name	[(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate;sodium;tetrahydrate
InChI Key	CTPAMSRBXKGZCJ-WJQTVUBHNA-L
Molecular Formula	C10H12N5Na2O7P

1,322

Thermo Scientific Chemicals L(+)-Isovaline monohydrate, 99+%, (>99% ee)

CAS: 595-40-4 Molecular Formula: C5H11NO2 Molecular Weight (g/mol): 117.15 MDL Number: MFCD00145255,MFCD00800497,MFCD00800497,MFCD00272968 InChI Key: GCHPUFAZSONQIV-UHFFFAOYNA-N Synonym: d-isovaline,l-isovaline,s-2-amino-2-methylbutanoic acid,l-iso-valine,unii-ebv7h5w26h,ebv7h5w26h,isovaline, l,d--isovaline,2s-2-amino-2-methylbutanoic acid,s-2-amino-2-methylbutyric acid PubChem CID: 6971276 IUPAC Name: (2S)-2-amino-2-methylbutanoic acid SMILES: CCC(C)(N)C(O)=O

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Specifications

PubChem CID	6971276
CAS	595-40-4
Molecular Weight (g/mol)	117.15
MDL Number	MFCD00145255,MFCD00800497,MFCD00800497,MFCD00272968
SMILES	CCC(C)(N)C(O)=O
Synonym	d-isovaline,l-isovaline,s-2-amino-2-methylbutanoic acid,l-iso-valine,unii-ebv7h5w26h,ebv7h5w26h,isovaline, l,d--isovaline,2s-2-amino-2-methylbutanoic acid,s-2-amino-2-methylbutyric acid
IUPAC Name	(2S)-2-amino-2-methylbutanoic acid
InChI Key	GCHPUFAZSONQIV-UHFFFAOYNA-N
Molecular Formula	C5H11NO2

1,323

(S)-(-)-α-Amino-γ-butyrolactone hydrobromide, 99%, Thermo Scientific Chemicals

CAS: 15295-77-9 Molecular Formula: C4H8BrNO2 Molecular Weight (g/mol): 182.02 MDL Number: MFCD00012723,MFCD00674493 InChI Key: MKLNTBLOABOJFZ-UHFFFAOYNA-N Synonym: s-3-aminodihydrofuran-2 3h-one hydrobromide,s---alpha-amino-gamma-butyrolactone hydrobromide,l-homoserine lactone hydrobromide,s-2-amino-4-butyrolactone hydrobromide,l---alpha-amino-gamma-butyrolactone hydrobromide,2 3h-furanone, 3-aminodihydro-, hydrobromide, 3s,s---alpha-amino-gamma-butyrolactonehydrobromide,ksc924k2j,l---?-amino-?-butyrolactone hydrobromide,s---alpha-amino-gamma-butyrolactone hbr PubChem CID: 16213138 SMILES: Br.NC1CCOC1=O

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Specifications

PubChem CID	16213138
CAS	15295-77-9
Molecular Weight (g/mol)	182.02
MDL Number	MFCD00012723,MFCD00674493
SMILES	Br.NC1CCOC1=O
Synonym	s-3-aminodihydrofuran-2 3h-one hydrobromide,s---alpha-amino-gamma-butyrolactone hydrobromide,l-homoserine lactone hydrobromide,s-2-amino-4-butyrolactone hydrobromide,l---alpha-amino-gamma-butyrolactone hydrobromide,2 3h-furanone, 3-aminodihydro-, hydrobromide, 3s,s---alpha-amino-gamma-butyrolactonehydrobromide,ksc924k2j,l---?-amino-?-butyrolactone hydrobromide,s---alpha-amino-gamma-butyrolactone hbr
InChI Key	MKLNTBLOABOJFZ-UHFFFAOYNA-N
Molecular Formula	C4H8BrNO2

1,324

(2R,4S)-N-BOC-4-Hydroxypiperidine-2-carboxylic acid methyl ester, 95%, 98% ee, Thermo Scientific Chemicals

CAS: 321744-26-7 Molecular Formula: C12H21NO5 Molecular Weight (g/mol): 259.30 MDL Number: MFCD02259744 InChI Key: RNMVWSAJMIKMDY-DTWKUNHWSA-N PubChem CID: 2734504 IUPAC Name: 1-O-tert-butyl 2-O-methyl (2R,4S)-4-hydroxypiperidine-1,2-dicarboxylate SMILES: COC(=O)[C@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C

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Specifications

PubChem CID	2734504
CAS	321744-26-7
Molecular Weight (g/mol)	259.30
MDL Number	MFCD02259744
SMILES	COC(=O)[C@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C
IUPAC Name	1-O-tert-butyl 2-O-methyl (2R,4S)-4-hydroxypiperidine-1,2-dicarboxylate
InChI Key	RNMVWSAJMIKMDY-DTWKUNHWSA-N
Molecular Formula	C12H21NO5

1,325

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

CAS: 83730-53-4 Molecular Formula: C₈H₁₈N₂O₃S Molecular Weight (g/mol): 222.31 MDL Number: MFCD00067000 InChI Key: KJQFBVYMGADDTQ-CVSPRKDYSA-N Synonym: l-buthionine-sulfoximine,l-buthionine sulfoximine,2s-2-amino-4-butylsulfonimidoyl butanoic acid,l-buthionine-s,r-sulfoximine,l-buthionine s,r-sulfoximine,l-bso,butanoic acid, 2-amino-4-s-butylsulfonimidoyl-, 2s,l-buthionine sr-sulfoximine,buthionine-s,r-sulfoximine, l,l-buthionine-s,r-sulphoximine PubChem CID: 119565 IUPAC Name: (2S)-2-amino-4-(butylsulfonimidoyl)butanoic acid SMILES: CCCCS(=N)(=O)CCC(C(=O)O)N

Pricing & Availability
Specifications

PubChem CID	119565
CAS	83730-53-4
Molecular Weight (g/mol)	222.31
MDL Number	MFCD00067000
SMILES	CCCCS(=N)(=O)CCC(C(=O)O)N
Synonym	l-buthionine-sulfoximine,l-buthionine sulfoximine,2s-2-amino-4-butylsulfonimidoyl butanoic acid,l-buthionine-s,r-sulfoximine,l-buthionine s,r-sulfoximine,l-bso,butanoic acid, 2-amino-4-s-butylsulfonimidoyl-, 2s,l-buthionine sr-sulfoximine,buthionine-s,r-sulfoximine, l,l-buthionine-s,r-sulphoximine
IUPAC Name	(2S)-2-amino-4-(butylsulfonimidoyl)butanoic acid
InChI Key	KJQFBVYMGADDTQ-CVSPRKDYSA-N
Molecular Formula	C₈H₁₈N₂O₃S

1,326

Boron trifluoride - acetic acid complex, ca. 33% BF3

CAS: 373-61-5 Molecular Formula: C4H8BF3O4 Molecular Weight (g/mol): 187.91 MDL Number: MFCD00036359 InChI Key: OVYKFNOIPQYMRU-UHFFFAOYSA-K Synonym: boron trifluoride acetic acid complex,bf3.c4h8o4,acetic acid-boron trifluoride complex,acetic acid boron trifluoride 2:1,bis acetic acid ; boron trifluoride,boron trifluoride acetic acid complex, technical bf3 basis,borate 1-, bis acetato-o difluoro-, dihydrogen fluoride, beta-4,borate 1-, bis acetato-.kappa.o difluoro-, hydrogen fluoride 1:2:1 , t-4 PubChem CID: 11116786 IUPAC Name: acetic acid;trifluoroborane SMILES: [H+].[H+].[B+3].[F-].[F-].[F-].CC([O-])=O.CC([O-])=O

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Specifications

PubChem CID	11116786
CAS	373-61-5
Molecular Weight (g/mol)	187.91
MDL Number	MFCD00036359
SMILES	[H+].[H+].[B+3].[F-].[F-].[F-].CC([O-])=O.CC([O-])=O
Synonym	boron trifluoride acetic acid complex,bf3.c4h8o4,acetic acid-boron trifluoride complex,acetic acid boron trifluoride 2:1,bis acetic acid ; boron trifluoride,boron trifluoride acetic acid complex, technical bf3 basis,borate 1-, bis acetato-o difluoro-, dihydrogen fluoride, beta-4,borate 1-, bis acetato-.kappa.o difluoro-, hydrogen fluoride 1:2:1 , t-4
IUPAC Name	acetic acid;trifluoroborane
InChI Key	OVYKFNOIPQYMRU-UHFFFAOYSA-K
Molecular Formula	C4H8BF3O4

1,327

3-Amino-1H-1,2,4-triazole-5-carboxylic acid hydrate, 98%, Thermo Scientific™

CAS: 1266615-63-7 Molecular Formula: C3H4N4O2 Molecular Weight (g/mol): 128.09 MDL Number: MFCD00010620 MFCD00179325 MFCD00225624 InChI Key: MVRGLMCHDCMPKD-UHFFFAOYSA-N IUPAC Name: 3-amino-1H-1,2,4-triazole-5-carboxylic acid SMILES: NC1=NNC(=N1)C(O)=O

Pricing & Availability
Specifications

CAS	1266615-63-7
Molecular Weight (g/mol)	128.09
MDL Number	MFCD00010620 MFCD00179325 MFCD00225624
SMILES	NC1=NNC(=N1)C(O)=O
IUPAC Name	3-amino-1H-1,2,4-triazole-5-carboxylic acid
InChI Key	MVRGLMCHDCMPKD-UHFFFAOYSA-N
Molecular Formula	C3H4N4O2

1,328

(±)-Ibotenic acid monohydrate, 95%, Thermo Scientific Chemicals

CAS: 60573-88-8 Molecular Formula: C₅H₆N₂O₄·H₂O Molecular Weight (g/mol): 176.1 MDL Number: MFCD00149579 InChI Key: QVKQQLYSTODTJN-UHFFFAOYSA-N Synonym: ibotenic acid hydrate,ibotenic acid monohydrate,pramuscimol,ibotensaeure,isotenic acid,ibotensaeure german,amino-3-hydroxy-5-isoxazolyl acetic acid,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat,alpha-amino-3-hydroxy-5-isoxazoleacetic acid hydrate,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat german PubChem CID: 43362 IUPAC Name: 2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid;hydrate SMILES: C1=C(ONC1=O)C(C(=O)O)N.O

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Specifications

PubChem CID	43362
CAS	60573-88-8
Molecular Weight (g/mol)	176.1
MDL Number	MFCD00149579
SMILES	C1=C(ONC1=O)C(C(=O)O)N.O
Synonym	ibotenic acid hydrate,ibotenic acid monohydrate,pramuscimol,ibotensaeure,isotenic acid,ibotensaeure german,amino-3-hydroxy-5-isoxazolyl acetic acid,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat,alpha-amino-3-hydroxy-5-isoxazoleacetic acid hydrate,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat german
IUPAC Name	2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid;hydrate
InChI Key	QVKQQLYSTODTJN-UHFFFAOYSA-N
Molecular Formula	C₅H₆N₂O₄·H₂O

1,329

Triphosphopyridine nucleotide, disodium salt, 97+%

CAS: 24292-60-2 Molecular Formula: C21H26N7Na2O17P3 Molecular Weight (g/mol): 787.37 MDL Number: MFCD00065390 InChI Key: WSDDJLMGYRLUKR-MWLGWILCNA-L Synonym: nadp disodium salt,beta-nicotinamide adenine dinucleotide phosphate disodium salt PubChem CID: 131851653 SMILES: [Na+].[Na+].NC(=O)C1=CC=C[N+](=C1)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](OP(O)([O-])=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O

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Specifications

PubChem CID	131851653
CAS	24292-60-2
Molecular Weight (g/mol)	787.37
MDL Number	MFCD00065390
SMILES	[Na+].[Na+].NC(=O)C1=CC=C[N+](=C1)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](OP(O)([O-])=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O
Synonym	nadp disodium salt,beta-nicotinamide adenine dinucleotide phosphate disodium salt
InChI Key	WSDDJLMGYRLUKR-MWLGWILCNA-L
Molecular Formula	C21H26N7Na2O17P3

1,330

Ethyl morpholinoacetate, 98%, Thermo Scientific™

CAS: 3235-82-3 Molecular Formula: C₈H₁₅NO₃ Molecular Weight (g/mol): 173.21 MDL Number: MFCD00023375 InChI Key: SITMDWHJQROIPF-UHFFFAOYSA-N Synonym: ethyl 2-morpholinoacetate,4-morpholineacetic acid, ethyl ester,ethyl morpholinoacetate,ethyl 2-morpholin-4-yl acetate,morpholin-4-yl-acetic acid ethyl ester,ethyl 4-morpholineacetate,ethyl-2-morpholinoacetate,ethyl 4-morpholinylacetate,ethyl morpholin-4-ylacetate,morpholinoacetic acid ethyl ester PubChem CID: 2734105 IUPAC Name: ethyl 2-morpholin-4-ylacetate SMILES: CCOC(=O)CN1CCOCC1

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Specifications

PubChem CID	2734105
CAS	3235-82-3
Molecular Weight (g/mol)	173.21
MDL Number	MFCD00023375
SMILES	CCOC(=O)CN1CCOCC1
Synonym	ethyl 2-morpholinoacetate,4-morpholineacetic acid, ethyl ester,ethyl morpholinoacetate,ethyl 2-morpholin-4-yl acetate,morpholin-4-yl-acetic acid ethyl ester,ethyl 4-morpholineacetate,ethyl-2-morpholinoacetate,ethyl 4-morpholinylacetate,ethyl morpholin-4-ylacetate,morpholinoacetic acid ethyl ester
IUPAC Name	ethyl 2-morpholin-4-ylacetate
InChI Key	SITMDWHJQROIPF-UHFFFAOYSA-N
Molecular Formula	C₈H₁₅NO₃

1,331

1-Octadecanesulfonic acid, sodium salt, 90%

CAS: 13893-34-0 Molecular Formula: C₁₈H₃₇NaO₃S Molecular Weight (g/mol): 356.54 MDL Number: MFCD00051526 InChI Key: KBAFDSIZQYCDPK-UHFFFAOYSA-M Synonym: sodium 1-octadecanesulfonate,sodium octadecane-1-sulfonate,sodium stearylsulfonate,sodium octadecanesulfonate,1-octadecanesulfonic acid sodium salt,sodium octadecane-1-sulphonate,1-octadecanesulfonic acid, sodium salt,sodium sterylsulfonate,sodium oxadecanesulfonate,sodium n-octadecylsulfonate PubChem CID: 23668003 IUPAC Name: sodium;octadecane-1-sulfonate SMILES: CCCCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]

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Specifications

PubChem CID	23668003
CAS	13893-34-0
Molecular Weight (g/mol)	356.54
MDL Number	MFCD00051526
SMILES	CCCCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
Synonym	sodium 1-octadecanesulfonate,sodium octadecane-1-sulfonate,sodium stearylsulfonate,sodium octadecanesulfonate,1-octadecanesulfonic acid sodium salt,sodium octadecane-1-sulphonate,1-octadecanesulfonic acid, sodium salt,sodium sterylsulfonate,sodium oxadecanesulfonate,sodium n-octadecylsulfonate
IUPAC Name	sodium;octadecane-1-sulfonate
InChI Key	KBAFDSIZQYCDPK-UHFFFAOYSA-M
Molecular Formula	C₁₈H₃₇NaO₃S

1,332

Methyltitanium(IV) triisopropoxide, 1M solution in THF

CAS: 18006-13-8 Molecular Formula: C₁₀H₂₄O₃Ti Molecular Weight (g/mol): 240.18 MDL Number: MFCD03411233 InChI Key: QBLPAZNBFFURKB-UHFFFAOYSA-N Synonym: titanium, methyltripropoxy,titanium,methyltris 2-propanolato-, t-4,methyltitanium triisopropoxide, 1m in tetrahydrofuran PubChem CID: 144064 IUPAC Name: carbanide;propan-2-ol;titanium SMILES: [CH3-].CC(C)O.CC(C)O.CC(C)O.[Ti]

Pricing & Availability
Specifications

PubChem CID	144064
CAS	18006-13-8
Molecular Weight (g/mol)	240.18
MDL Number	MFCD03411233
SMILES	[CH3-].CC(C)O.CC(C)O.CC(C)O.[Ti]
Synonym	titanium, methyltripropoxy,titanium,methyltris 2-propanolato-, t-4,methyltitanium triisopropoxide, 1m in tetrahydrofuran
IUPAC Name	carbanide;propan-2-ol;titanium
InChI Key	QBLPAZNBFFURKB-UHFFFAOYSA-N
Molecular Formula	C₁₀H₂₄O₃Ti

1,333

Guanylurea sulfate, 97%

CAS: 591-01-5 Molecular Formula: C₄H₁₂N₈O₂·H₂SO₄ Molecular Weight (g/mol): 302.26 MDL Number: MFCD00035565

Pricing & Availability
Specifications

CAS	591-01-5
Molecular Weight (g/mol)	302.26
MDL Number	MFCD00035565
Molecular Formula	C₄H₁₂N₈O₂·H₂SO₄

1,334

Methyl isocyanoacetate, 95%, Tech.

CAS: 39687-95-1 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.11 MDL Number: MFCD00000006 InChI Key: ZRGVTTCCASYOFN-UHFFFAOYSA-N Synonym: methyl isocyanoacetate,isocyanoacetic acid methyl ester,methylisocyanoacetate,isocyano-acetic acid methyl ester,acetic acid,2-isocyano-, methyl ester,methyl-isocyanoacetate,methyl isocyano-acetate,acmc-20akf8,methyl alpha-isocyanoacetate,ksc581o3d PubChem CID: 547815 IUPAC Name: methyl 2-isocyanoacetate SMILES: COC(=O)CN=C

Pricing & Availability
Specifications

PubChem CID	547815
CAS	39687-95-1
Molecular Weight (g/mol)	101.11
MDL Number	MFCD00000006
SMILES	COC(=O)CN=C
Synonym	methyl isocyanoacetate,isocyanoacetic acid methyl ester,methylisocyanoacetate,isocyano-acetic acid methyl ester,acetic acid,2-isocyano-, methyl ester,methyl-isocyanoacetate,methyl isocyano-acetate,acmc-20akf8,methyl alpha-isocyanoacetate,ksc581o3d
IUPAC Name	methyl 2-isocyanoacetate
InChI Key	ZRGVTTCCASYOFN-UHFFFAOYSA-N
Molecular Formula	C4H7NO2

1,335

1,4-Dioxaspiro[4.5]decan-8-one, 98%

CAS: 4746-97-8 Molecular Formula: C₈H₁₂O₃ Molecular Weight (g/mol): 156.18 MDL Number: MFCD00010214 InChI Key: VKRKCBWIVLSRBJ-UHFFFAOYSA-N Synonym: 1,4-dioxaspiro 4.5 decan-8-one,1,4-cyclohexanedione monoethylene acetal,1,4-cyclohexanedione monoethylene ketal,1,4-cyclohexanedione monoethyleneacetal,1,4-dioxa-spiro 4.5 decan-8-one,1,4-cyclohexanedione monoethyleneketal,cyclohexane-1,4-dione monoethylene ketal,1,4-dioxaspiro 4.5 decane-8-one PubChem CID: 567415 IUPAC Name: 1,4-dioxaspiro[4.5]decan-8-one SMILES: C1CC2(CCC1=O)OCCO2

Pricing & Availability
Specifications

PubChem CID	567415
CAS	4746-97-8
Molecular Weight (g/mol)	156.18
MDL Number	MFCD00010214
SMILES	C1CC2(CCC1=O)OCCO2
Synonym	1,4-dioxaspiro 4.5 decan-8-one,1,4-cyclohexanedione monoethylene acetal,1,4-cyclohexanedione monoethylene ketal,1,4-cyclohexanedione monoethyleneacetal,1,4-dioxa-spiro 4.5 decan-8-one,1,4-cyclohexanedione monoethyleneketal,cyclohexane-1,4-dione monoethylene ketal,1,4-dioxaspiro 4.5 decane-8-one
IUPAC Name	1,4-dioxaspiro[4.5]decan-8-one
InChI Key	VKRKCBWIVLSRBJ-UHFFFAOYSA-N
Molecular Formula	C₈H₁₂O₃

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